data_1j2o_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 1j2o _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 121.133 0.492 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.522 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.575 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.575 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.541 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.58 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.812 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 97' ' ' ILE . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.756 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.756 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.812 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.934 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.934 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.566 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.531 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.593 HD11 ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.464 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.593 ' HB3' HD11 ' A' ' 55' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.469 ' HB2' HD23 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--O 1.236 0.355 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.905 ' HB ' HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.472 ' O ' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.795 ' HA ' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m . . . . . 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 12' ' ' ASN . 4.0 mt . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.496 HD21 ' CZ ' ' A' ' 18' ' ' PHE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.516 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.516 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.52 HD22 HD12 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.727 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.747 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.724 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.545 HD23 ' HG3' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.905 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.67 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.905 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.67 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 1.059 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 1.059 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.447 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.885 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.447 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.487 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.46 ' H ' HD13 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.771 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.418 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.771 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.885 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.552 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.747 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.724 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.652 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.775 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.652 ' HA ' HG23 ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.479 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.564 ' CD2' ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.886 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.886 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.885 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.885 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 97' ' ' ILE . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.9 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB2' HD11 ' A' ' 55' ' ' LEU . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.9 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.73 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.966 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.966 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.449 ' HB2' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.73 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.495 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.498 ' HB2' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.564 ' HB ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.534 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.559 HD22 ' HE3' ' A' ' 20' ' ' LYS . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.564 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.611 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.611 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.563 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.819 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.402 ' HB1' ' O ' ' A' ' 20' ' ' LYS . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.469 HG13 ' HE1' ' A' ' 26' ' ' TRP . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.819 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.469 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.981 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.981 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.703 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.5 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.168 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.721 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.513 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.478 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.478 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.721 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.703 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.65 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.484 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.448 ' HG ' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.528 HD11 HD23 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.536 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mp . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.492 HD21 ' OD1' ' A' ' 102' ' ' ASN . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.619 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.525 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.619 ' HA ' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.551 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.771 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.42 HD23 HG21 ' A' ' 97' ' ' ILE . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' HG22 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.821 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.793 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.422 ' CE3' HD21 ' A' ' 31' ' ' LEU . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.771 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.422 HD21 ' CE3' ' A' ' 26' ' ' TRP . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 1.002 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.821 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.666 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.413 HD23 ' HD2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 1.002 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.612 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.476 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.666 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.821 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.45 ' N ' HG21 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.406 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.2 m . . . . . 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.662 0.268 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.718 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.718 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.429 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.428 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.938 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.437 ' HB2' HG22 ' A' ' 97' ' ' ILE . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.938 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.513 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.935 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.413 HD22 ' HB3' ' A' ' 59' ' ' ASP . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.935 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.49 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 80.1 t80 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-O 120.964 0.411 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.851 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.417 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.444 HD22 ' H ' ' A' ' 52' ' ' GLY . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.444 ' H ' HD22 ' A' ' 51' ' ' LEU . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.417 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.655 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.49 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.655 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.789 0.328 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.437 HG22 ' HB2' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.425 ' HD2' HD23 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.75 HD11 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.748 0.308 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.528 ' HA ' HG22 ' A' ' 5' ' ' THR . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.449 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.581 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.624 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 26' ' ' TRP . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.962 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.425 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.816 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.702 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.962 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.878 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.526 ' HD3' HD12 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.526 HD12 ' HD3' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.593 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.878 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.816 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.466 HG13 ' C ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.624 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.418 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.451 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.496 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.855 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.855 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.496 ' HA ' HG21 ' A' ' 5' ' ' THR . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.601 ' O ' HD23 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.995 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.488 ' O ' ' HB2' ' A' ' 23' ' ' ASP . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.425 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.995 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.474 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.474 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.911 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 . . . . . 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 1.012 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HG3' ' CD2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 1.012 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.418 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.547 ' HB ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.572 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.448 HD21 ' HE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.461 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.6 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.477 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.844 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.608 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.477 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.608 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.6 ' HA ' HG23 ' A' ' 5' ' ' THR . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.41 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.689 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.607 ' HG ' ' HG3' ' A' ' 99' ' ' ARG . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.507 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.507 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.89 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.89 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 1.056 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.62 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.538 ' HB2' HD23 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.844 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 1.056 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.417 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.746 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.512 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.54 ' HB ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.689 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.412 ' H ' ' HG ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.461 ' OD1' HD12 ' A' ' 4' ' ' LEU . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.488 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.488 ' HA ' HG21 ' A' ' 5' ' ' THR . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.878 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HB1' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.721 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.46 ' C ' ' HB2' ' A' ' 6' ' ' CYS . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.717 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.717 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.616 HD21 ' HB3' ' A' ' 59' ' ' ASP . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.421 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.439 ' HD3' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' N ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.559 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.421 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.616 ' HB3' HD21 ' A' ' 35' ' ' LEU . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.559 ' HB2' HD23 ' A' ' 55' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.488 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.878 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.469 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.553 HD11 ' CZ ' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.483 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' HB3' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.463 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.623 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.65 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.858 HD21 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.549 HD12 ' CZ2' ' A' ' 26' ' ' TRP . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.549 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.46 ' HA ' HD11 ' A' ' 31' ' ' LEU . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.489 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.543 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.501 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.501 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 34' ' ' ASP . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.533 ' SG ' ' HB2' ' A' ' 58' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.633 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.533 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.633 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.858 ' HB ' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.623 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.65 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.515 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.586 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.455 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.455 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.586 ' HA ' HG21 ' A' ' 5' ' ' THR . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.473 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.498 HD23 ' HG2' ' A' ' 99' ' ' ARG . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.895 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.789 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.895 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.789 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.862 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.862 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.608 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.406 ' HB2' HD13 ' A' ' 55' ' ' LEU . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.608 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 1.064 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.457 HD11 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.457 ' H ' HD11 ' A' ' 51' ' ' LEU . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 1.064 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.588 HD21 ' HB2' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HA ' ' HB3' ' A' ' 60' ' ' TYR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.6 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.44 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.638 0.256 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.591 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.498 ' HG2' HD23 ' A' ' 19' ' ' LEU . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.501 ' N ' HD21 ' A' ' 3' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-O 120.865 0.364 . . . . 0.0 110.431 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.579 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.582 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.54 ' NE2' ' HE1' ' A' ' 27' ' ' HIS . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.582 ' HA ' HG21 ' A' ' 5' ' ' THR . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.487 ' CD1' HD13 ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.691 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.826 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 20' ' ' LYS . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.826 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.4 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.814 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 6.6 m80 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.422 ' HA ' HD11 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.671 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.634 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.743 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.671 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 CA-C-O 120.88 0.371 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.694 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.655 ' HB2' HD23 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.441 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.694 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.655 HD23 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.743 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.604 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.459 ' HB ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.691 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t . . . . . 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 C--O 1.232 0.173 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.508 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.611 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.611 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.477 ' HA ' HG23 ' A' ' 5' ' ' THR . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.522 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.768 HD22 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HB1' HD12 ' A' ' 96' ' ' LEU . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.574 HD13 ' CZ2' ' A' ' 26' ' ' TRP . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.574 ' CZ2' HD13 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.973 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.973 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.852 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.503 ' CB ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.852 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.455 -0.175 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.987 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.987 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.579 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.579 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.464 ' HA ' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.517 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.602 HD12 ' HB1' ' A' ' 21' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.768 ' HD2' HD22 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.588 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mt . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.723 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.478 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.459 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.478 ' HA ' HG22 ' A' ' 5' ' ' THR . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.433 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.565 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.704 HD23 HD13 ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.856 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.662 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.662 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.856 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.487 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.851 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.643 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.595 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.456 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.851 HD11 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.643 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.448 ' HB2' HD12 ' A' ' 55' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.9 mt . . . . . 0 N--CA 1.461 0.09 0 CA-C-O 120.789 0.328 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.704 HD13 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.562 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.565 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB2' ' HB ' ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.598 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.598 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.621 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.493 HD21 ' HD2' ' A' ' 99' ' ' ARG . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.963 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.834 HD12 ' HB3' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.963 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.567 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.784 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.784 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.529 HD11 HD11 ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.452 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.452 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.421 ' CE2' ' HG3' ' A' ' 57' ' ' ARG . 1.4 t80 . . . . . 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.679 ' HB3' ' H ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.617 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.617 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.834 ' HB3' HD12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.421 ' HG3' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.417 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.679 ' H ' ' HB3' ' A' ' 49' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.529 HD11 HD11 ' A' ' 31' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.621 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.405 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.407 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.618 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.618 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.509 HG22 ' OD1' ' A' ' 102' ' ' ASN . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.644 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.585 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.526 ' HB1' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.573 ' HA ' HD11 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.926 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.555 ' CE3' HD22 ' A' ' 31' ' ' LEU . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 1.019 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 1.019 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.565 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.585 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.464 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.915 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.565 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.82 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.54 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.82 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.915 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.64 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.618 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.618 ' CD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.573 HD11 ' HA ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 120.508 0.194 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.526 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.489 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.644 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.509 ' OD1' HG22 ' A' ' 13' ' ' ILE . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.542 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.415 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.585 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.585 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.542 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.601 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.536 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.444 ' HB1' ' HA ' ' A' ' 97' ' ' ILE . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.784 HD13 ' HA ' ' A' ' 48' ' ' TYR . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.578 HD21 HG12 ' A' ' 97' ' ' ILE . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.403 ' HB3' ' H ' ' A' ' 33' ' ' CYS . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.691 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.585 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.691 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.784 ' HA ' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.146 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.816 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.617 ' HD3' HD12 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.617 HD12 ' HD3' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.485 ' N ' HD23 ' A' ' 51' ' ' LEU . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.816 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.507 HD13 HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.684 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.533 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.684 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.42 ' C ' HG13 ' A' ' 97' ' ' ILE . 30.4 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.565 0.221 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.687 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.41 HD22 HD21 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 102' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.198 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.542 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.543 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.543 ' HA ' HG21 ' A' ' 5' ' ' THR . 5.4 t30 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.588 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.846 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.541 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.578 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.846 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.578 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.563 HD12 HD11 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.453 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.546 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 5.4 m-85 . . . . . 0 CA--C 1.512 -0.497 0 CA-C-O 120.68 0.276 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.719 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.471 ' HG3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG3' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.719 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.716 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.763 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.546 ' HD3' ' CD1' ' A' ' 48' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.481 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.569 ' HB2' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.763 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 96' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.563 HD11 HD12 ' A' ' 31' ' ' LEU . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.588 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.637 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.655 HD22 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.665 HD11 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLY . . . . . 0.405 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.613 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.665 ' HA2' HD11 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.616 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.813 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.646 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.629 HD23 HD13 ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.638 ' HE3' HD23 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . 0.513 HG13 ' NE1' ' A' ' 26' ' ' TRP . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.9 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.646 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.574 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.914 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.914 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.574 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.52 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.859 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.41 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.859 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.596 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.563 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.705 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.592 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.629 HD13 HD23 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' THR . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.638 HD23 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . 0.813 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . 0.616 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 48.2 t-20 -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 N-CA-C 112.001 -0.44 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.489 ' HA ' ' OD1' ' A' ' 12' ' ' ASN . 1.3 m -82.86 121.04 26.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.148 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.69 HD23 ' HG3' ' A' ' 104' ' ' GLN . 0.5 OUTLIER -115.77 -67.17 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.242 179.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.569 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.522 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.575 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.575 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.541 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.58 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.905 HD13 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.812 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' HG21 ' A' ' 97' ' ' ILE . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.756 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.756 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.812 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.472 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.934 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.934 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.456 HD13 ' HB3' ' A' ' 19' ' ' LEU . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.566 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.462 ' HB2' ' HG ' ' A' ' 38' ' ' CYS . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.94 42.21 8.27 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.462 ' HG ' ' HB2' ' A' ' 36' ' ' CYS . 1.6 p -110.68 -118.22 0.29 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.508 ' C ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -170.83 43.66 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.278 177.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.524 HD11 HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER 43.01 -112.7 0.22 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.712 176.541 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.625 ' O ' ' HA ' ' A' ' 96' ' ' LEU . . . -172.84 89.09 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -71.31 56.05 0.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.591 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 2.7 t -122.24 92.45 2.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -40.01 112.56 0.3 Allowed Glycine 0 C--N 1.328 0.136 0 CA-C-N 114.956 -1.02 . . . . 0.0 114.548 -171.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.496 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -158.97 -93.08 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.496 ' H ' ' HB3' ' A' ' 45' ' ' ARG . 1.1 mmp_? -104.12 -169.85 1.69 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.833 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.764 HD12 ' HG3' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -155.65 148.79 24.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.897 0.379 . . . . 0.0 110.578 173.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.759 ' HB2' ' HA ' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -129.38 119.07 23.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.361 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.438 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.531 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.593 HD11 ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.801 ' HA ' HH12 ' A' ' 95' ' ' ARG . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.638 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.593 ' HB3' HD11 ' A' ' 55' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.469 ' HB2' HD23 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -66.25 -30.55 71.01 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.769 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 3.7 tp -75.32 -17.0 60.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.138 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -20.98 37.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.535 -176.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.63 -43.85 2.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 -177.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.72 39.18 2.02 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.144 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.769 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -124.21 -112.96 2.01 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.433 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 13.7 m -142.61 9.37 1.79 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 111.453 0.168 . . . . 0.0 111.453 178.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.576 ' HA3' ' HG2' ' A' ' 88' ' ' GLU . . . -106.72 -122.34 4.91 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 119.703 -1.237 . . . . 0.0 113.04 -176.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.81 35.39 9.2 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.225 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -125.25 -171.75 2.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.74 -48.07 5.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.86 0.362 . . . . 0.0 110.084 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.405 ' O ' ' HA3' ' A' ' 86' ' ' GLY . . . -69.79 108.86 2.63 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.22 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.23 159.23 16.26 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.724 ' HA3' ' O ' ' A' ' 83' ' ' THR . . . 107.16 -160.97 13.91 Favored Glycine 0 C--O 1.218 -0.862 0 CA-C-N 116.396 -0.366 . . . . 0.0 112.431 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.957 ' H ' ' HA ' ' A' ' 84' ' ' LEU . . . -93.46 148.45 19.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -72.99 95.09 1.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.087 0.443 . . . . 0.0 110.999 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.34 164.49 26.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.816 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 49.2 mtm -52.98 129.98 32.23 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 123.389 0.43 . . . . 0.0 111.086 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.3 t -76.25 99.58 2.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.951 0.405 . . . . 0.0 110.848 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -111.56 -2.05 10.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.432 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 94.41 44.13 3.54 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.339 -0.705 . . . . 0.0 111.339 -177.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.01 156.5 42.68 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.89 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.97 166.06 29.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.848 2.365 . . . . 0.0 111.382 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.724 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 0.2 OUTLIER 53.11 -96.5 0.05 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.836 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.957 ' HA ' ' H ' ' A' ' 74' ' ' GLY . 0.4 OUTLIER -51.08 95.93 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -172.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.47 -47.25 0.42 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.754 172.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.405 ' HA3' ' O ' ' A' ' 71' ' ' GLY . . . -123.99 -102.62 1.52 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 120.832 -0.699 . . . . 0.0 114.064 -174.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -144.38 -29.72 0.1 Allowed Glycine 0 C--N 1.336 0.58 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.94 -175.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.576 ' HG2' ' HA3' ' A' ' 67' ' ' GLY . 3.1 mt-10 -86.48 93.14 9.07 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.523 0.661 . . . . 0.0 109.903 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HA ' ' HA2' ' A' ' 73' ' ' GLY . 22.4 m-85 -59.54 -153.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -116.11 -111.02 2.72 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.964 -172.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.843 ' HA ' ' HG3' ' A' ' 94' ' ' GLU . 5.4 p-10 -122.65 -109.0 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 122.539 -0.389 . . . . 0.0 112.007 -173.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 16.7 mm-40 76.85 -44.92 0.48 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.177 0.991 . . . . 0.0 110.951 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -119.89 3.54 11.04 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.13 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.843 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 2.3 mm-40 -78.03 -163.49 0.43 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.473 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.801 HH12 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -67.75 73.78 0.17 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.091 -175.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.625 ' HA ' ' O ' ' A' ' 41' ' ' GLY . 1.5 mt -95.81 76.39 3.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.905 ' HB ' HD13 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.472 ' O ' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.795 ' HA ' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m -63.35 -42.27 98.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.69 ' HG3' HD23 ' A' ' 3' ' ' LEU . 10.4 mt-30 -95.07 61.24 2.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.284 172.166 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.428 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -72.13 -24.58 61.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.955 -178.015 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -4.16 -68.39 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.045 1.738 . . . . 0.0 114.127 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.578 ' HB1' ' O ' ' A' ' 110' ' ' GLY . . . 72.32 64.02 0.12 Allowed 'General case' 0 C--O 1.233 0.203 0 O-C-N 124.254 0.971 . . . . 0.0 110.303 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.8 65.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.069 -175.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -125.33 45.64 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.043 0.449 . . . . 0.0 110.865 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.578 ' O ' ' HB1' ' A' ' 107' ' ' ALA . . . 73.86 -111.75 3.56 Favored Glycine 0 C--O 1.226 -0.36 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.0 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -94.64 43.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.887 0.851 . . . . 0.0 109.777 175.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -160.46 137.91 9.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.597 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -119.63 172.82 7.4 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.92 0.391 . . . . 0.0 111.381 -177.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.248 0.987 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.932 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.9 162.29 14.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.52 HD12 HD22 ' A' ' 12' ' ' ASN . 4.0 mt -74.51 163.92 27.2 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.496 HD21 ' CZ ' ' A' ' 18' ' ' PHE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.401 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.516 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.516 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.52 HD22 HD12 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.727 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.747 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.724 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.545 HD23 ' HG3' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.905 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.67 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.905 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.67 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 1.059 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.499 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 1.059 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.447 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.791 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.885 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.447 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . 84.71 15.64 67.6 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -78.02 -90.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.078 0.466 . . . . 0.0 110.139 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.507 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -165.64 144.09 6.05 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 176.255 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.662 HD12 ' HB2' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -69.91 120.6 15.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.061 0.458 . . . . 0.0 111.483 -175.032 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 112.61 -57.97 0.42 Allowed Glycine 0 N--CA 1.442 -0.937 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.505 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 49.63 -107.56 0.26 Allowed 'General case' 0 CA--C 1.53 0.196 0 O-C-N 124.058 0.505 . . . . 0.0 110.785 179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -100.25 86.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 172.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.02 166.37 17.18 Favored Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.806 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.78 9.01 7.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.085 0.469 . . . . 0.0 110.515 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.98 92.01 8.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.104 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.626 HD11 HD21 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -86.92 85.23 7.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.27 0.557 . . . . 0.0 111.03 -177.643 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.418 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -94.79 162.51 13.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.354 173.511 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.487 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.46 ' H ' HD13 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.662 ' HB2' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.564 HD12 ' HA ' ' A' ' 60' ' ' TYR . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.771 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.474 ' NH2' ' HB2' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.771 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.885 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' HA ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.83 -42.06 50.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.583 ' HB3' ' O ' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -74.18 -49.7 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.501 -177.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.446 HH11 ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -164.08 -86.44 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 175.846 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.58 -39.67 2.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 168.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 58' ' ' ARG . . . -120.62 -61.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.689 174.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.583 ' O ' ' HB3' ' A' ' 61' ' ' LEU . . . -142.39 -107.54 0.63 Allowed Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.871 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.37 -20.1 20.68 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.768 -0.216 . . . . 0.0 110.593 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 26.05 43.39 0.02 OUTLIER Glycine 0 N--CA 1.467 0.761 0 O-C-N 124.295 0.997 . . . . 0.0 115.573 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -116.23 -55.8 0.33 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.724 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -124.8 -91.65 0.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.594 0.235 . . . . 0.0 110.546 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 mtp -107.65 -34.92 6.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.018 0.437 . . . . 0.0 110.742 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.88 118.78 3.66 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.148 -174.125 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.575 ' HB2' ' CA ' ' A' ' 86' ' ' GLY . 0.0 OUTLIER -94.09 5.79 50.61 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -172.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -103.32 -51.7 0.97 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.233 174.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.12 167.94 24.98 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.075 -0.583 . . . . 0.0 111.975 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.23 119.47 15.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.922 0.391 . . . . 0.0 109.987 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.12 120.41 46.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.938 -174.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.404 ' H ' ' HG3' ' A' ' 77' ' ' MET . 0.3 OUTLIER -82.78 158.95 22.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.454 -179.098 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.7 t -81.25 66.82 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.308 0.575 . . . . 0.0 109.956 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -135.37 9.96 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.012 -174.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.85 78.09 1.04 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -59.34 123.89 72.37 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.932 0.396 . . . . 0.0 111.669 -174.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.481 ' O ' ' HA3' ' A' ' 90' ' ' GLY . 88.0 Cg_endo -86.34 -175.6 1.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.922 2.415 . . . . 0.0 112.457 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 t -92.16 118.55 30.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.289 0.566 . . . . 0.0 110.336 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.597 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . 1.1 mt -119.38 124.8 47.48 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.665 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.78 22.63 7.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.209 0.528 . . . . 0.0 111.068 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.575 ' CA ' ' HB2' ' A' ' 72' ' ' SER . . . -98.66 -128.72 6.24 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.792 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.441 ' H ' ' C ' ' A' ' 72' ' ' SER . . . -85.52 -71.69 1.31 Allowed Glycine 0 C--O 1.225 -0.421 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.12 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.46 ' CG ' ' HA3' ' A' ' 65' ' ' GLY . 2.5 mp0 -83.75 96.96 8.89 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 122.519 -0.4 . . . . 0.0 110.709 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.597 ' HA ' ' HB2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -77.79 167.51 21.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.224 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 82' ' ' PRO . . . -97.14 -106.92 2.44 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.352 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.71 ' HB2' ' HG2' ' A' ' 94' ' ' GLU . 30.4 p-10 -86.91 -84.31 0.18 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.636 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 4.3 mt-10 67.57 -45.41 0.49 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.572 1.149 . . . . 0.0 112.531 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -135.92 35.16 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.582 0.705 . . . . 0.0 110.055 -177.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.71 ' HG2' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -77.37 161.56 27.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.494 -179.574 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.545 ' HB3' ' CZ ' ' A' ' 95' ' ' ARG . 1.9 ttp-105 -157.87 -174.01 4.64 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt -108.29 -172.19 2.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.552 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.747 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.724 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.433 ' HG3' ' HB2' ' A' ' 113' ' ' ASP . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.437 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -115.21 -104.91 0.4 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.437 ' H ' ' HB ' ' A' ' 103' ' ' THR . 1.0 OUTLIER -168.19 93.51 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 175.813 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.65 -57.71 1.12 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 -172.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -69.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.002 -174.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -139.31 -6.6 1.37 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.29 -11.13 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.863 0.364 . . . . 0.0 111.231 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.406 ' HB2' ' HB2' ' A' ' 104' ' ' GLN . 9.0 t-20 -117.12 32.19 6.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 110.071 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -165.61 -68.54 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.532 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.449 HG21 HD13 ' A' ' 111' ' ' ILE . 2.5 mm -98.19 -101.88 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.907 0.384 . . . . 0.0 110.382 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.422 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 28.9 t0 -153.82 131.86 11.76 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.433 ' HB2' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -56.87 120.13 7.4 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.405 0.44 . . . . 0.0 110.923 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 -175.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.09 124.81 28.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.742 0.306 . . . . 0.0 110.805 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt -102.43 -66.56 0.92 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.652 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.775 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.775 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.652 ' HA ' HG23 ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.479 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.528 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.564 ' CD2' ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.886 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.886 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.885 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.885 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.485 HD23 HD11 ' A' ' 97' ' ' ILE . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.9 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.544 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.493 ' HB2' HD11 ' A' ' 55' ' ' LEU . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.9 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 122.43 13.29 4.81 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.467 ' N ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -112.51 -98.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.264 0.532 . . . . 0.0 110.886 178.267 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.41 ' H ' ' HB2' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -145.04 146.99 32.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.966 0.412 . . . . 0.0 110.453 178.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.519 HD23 ' HA ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -82.66 59.4 4.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.015 0.436 . . . . 0.0 110.975 -177.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 74.26 40.4 41.34 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.596 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 58.58 -91.58 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.436 0.695 . . . . 0.0 111.698 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.98 129.44 37.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.772 0.32 . . . . 0.0 110.278 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.837 ' HA3' HD12 ' A' ' 97' ' ' ILE . . . -76.59 90.77 0.95 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.677 -177.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 4.3 ttm180 -113.91 -32.16 6.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.19 0.519 . . . . 0.0 110.195 179.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -121.64 80.78 1.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.395 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.62 106.48 8.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.322 0.582 . . . . 0.0 110.552 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.73 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -124.28 127.12 47.18 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.39 176.092 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.966 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.966 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.544 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.483 ' HB3' HD22 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.73 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.495 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.526 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -61.46 -33.65 74.12 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.511 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -61.84 -20.89 64.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.889 -176.106 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -25.71 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -116.41 -38.86 3.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.618 -179.092 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.91 -10.32 40.4 Favored Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.388 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.511 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -114.26 41.57 2.15 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.484 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 m 28.95 43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.025 0.93 . . . . 0.0 113.498 -174.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 25.91 41.91 0.01 OUTLIER Glycine 0 C--N 1.347 1.172 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 58.52 35.87 82.15 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.075 176.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.27 -62.77 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.507 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.34 -15.61 21.78 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.01 177.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 106.56 -30.58 9.3 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -174.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.465 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -91.85 178.55 5.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.985 -0.608 . . . . 0.0 110.353 176.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.549 ' HA3' ' HD1' ' A' ' 89' ' ' PHE . . . 178.74 -166.23 35.84 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.475 ' HA2' ' HA ' ' A' ' 89' ' ' PHE . . . 143.76 165.53 10.89 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.198 -1.001 . . . . 0.0 112.507 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -94.99 127.09 40.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.435 ' HA ' ' O ' ' A' ' 81' ' ' GLU . 15.6 t -72.18 98.66 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 5.9 mtt -82.01 154.36 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.909 -177.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.42 -15.66 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.335 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -79.53 15.4 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 111.213 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.08 39.49 37.31 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' O ' ' HA ' ' A' ' 76' ' ' VAL . 0.6 OUTLIER -114.25 99.16 50.4 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -88.79 -144.81 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.888 2.392 . . . . 0.0 112.11 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.22 116.67 4.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.913 0.387 . . . . 0.0 111.183 179.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.465 ' O ' ' HB3' ' A' ' 72' ' ' SER . 1.1 mp -79.41 127.33 31.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.081 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.67 6.93 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.659 -175.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.2 -0.35 65.66 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.322 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.76 84.94 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.745 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -79.42 105.28 10.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.929 0.395 . . . . 0.0 110.552 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.549 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 13.8 m-85 -81.99 -165.17 0.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.012 -176.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -83.66 36.68 2.8 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.866 -0.683 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.42 -112.62 0.1 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.855 0.359 . . . . 0.0 110.163 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.1 -67.31 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 27.1 t70 -140.73 -34.83 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.887 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.672 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 3.7 tt0 73.9 106.37 0.07 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.859 0.837 . . . . 0.0 110.92 -177.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.18 -145.42 0.21 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.83 -176.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.416 ' HB3' ' O ' ' A' ' 45' ' ' ARG . 0.3 OUTLIER -155.62 -139.31 0.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.419 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.837 HD12 ' HA3' ' A' ' 44' ' ' GLY . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.534 ' HG2' HD23 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.559 HD22 ' HE3' ' A' ' 20' ' ' LYS . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.491 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.413 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -83.78 -96.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.474 ' HA ' ' OE1' ' A' ' 101' ' ' GLU . 0.7 OUTLIER -168.33 86.63 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.9 70.52 1.47 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.195 0.521 . . . . 0.0 111.429 -175.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.416 ' HB2' ' OE2' ' A' ' 101' ' ' GLU . 6.2 t70 -124.99 -56.5 1.56 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.113 176.632 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 65.53 31.13 10.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.038 -1.437 . . . . 0.0 110.446 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.1 24.19 14.32 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.931 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -113.1 -5.8 13.71 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.099 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -114.51 -75.63 0.66 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.936 178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.92 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.102 0.477 . . . . 0.0 110.192 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -166.44 138.92 3.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.637 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -71.24 119.0 14.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.895 0.379 . . . . 0.0 110.767 -178.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.013 -179.502 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.39 155.62 31.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.972 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.55 -172.29 4.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.876 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.564 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.611 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.611 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.563 ' HB2' ' HB2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.536 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.563 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.819 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.642 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.469 HG13 ' HE1' ' A' ' 26' ' ' TRP . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.819 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.469 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.981 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.981 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.523 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.703 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.83 33.04 0.82 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 3.0 m -90.35 -111.17 0.08 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.312 0.556 . . . . 0.0 110.126 177.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.523 ' HD3' ' HB3' ' A' ' 32' ' ' SER . 0.3 OUTLIER -178.33 169.33 1.83 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.401 ' H ' ' HG3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -136.55 147.76 47.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.777 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.24 -0.57 1.4 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.553 -174.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.743 ' HB2' HD11 ' A' ' 96' ' ' LEU . 1.3 mp0 -86.08 171.69 11.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.926 0.363 . . . . 0.0 110.239 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.755 HG22 ' HA ' ' A' ' 98' ' ' THR . 60.6 t -133.37 138.47 51.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.373 -175.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.403 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -173.55 5.68 0.03 OUTLIER Glycine 0 CA--C 1.529 0.943 0 C-N-CA 119.227 -1.463 . . . . 0.0 115.372 172.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.58 ' CZ ' ' HG3' ' A' ' 95' ' ' ARG . 9.3 ttm180 176.04 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.077 0.939 . . . . 0.0 110.412 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.642 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 11.4 ptp180 -163.79 -1.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.595 ' HB2' ' O ' ' A' ' 46' ' ' ARG . 11.3 tp 151.34 142.42 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.169 1.388 . . . . 0.0 108.414 171.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.5 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.82 90.71 3.71 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.832 -1.147 . . . . 0.0 110.168 170.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.721 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.513 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.478 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.478 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.721 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.703 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.65 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.484 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -62.6 -38.87 91.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.671 ' HG ' ' H ' ' A' ' 66' ' ' SER . 0.5 OUTLIER -66.32 -24.49 66.54 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.349 -179.647 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.441 HH12 ' CD ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -66.42 -24.77 66.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.468 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.87 -34.61 4.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.664 -177.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -122.13 18.51 8.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.341 -0.933 . . . . 0.0 113.594 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.538 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -132.36 -112.68 1.41 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 120.096 -1.049 . . . . 0.0 111.944 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.671 ' H ' ' HG ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -138.78 20.67 2.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.906 0.384 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.625 ' HA2' ' HA2' ' A' ' 71' ' ' GLY . . . -82.45 -36.45 16.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.554 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -79.14 -25.01 60.35 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.534 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -78.53 -65.96 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.121 0.486 . . . . 0.0 109.905 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.728 ' HB3' ' HA3' ' A' ' 74' ' ' GLY . 0.6 OUTLIER -106.83 -64.02 1.22 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.714 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.625 ' HA2' ' HA2' ' A' ' 67' ' ' GLY . . . 99.61 -126.22 8.84 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.758 -0.735 . . . . 0.0 111.995 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.82 70.46 6.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 110.14 177.036 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 100.79 -70.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.324 -174.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.728 ' HA3' ' HB3' ' A' ' 70' ' ' MET . . . 87.13 -106.24 3.14 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.169 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -113.68 135.11 54.29 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.902 0.382 . . . . 0.0 110.631 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.452 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 17.4 t -70.6 108.51 2.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.146 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.576 ' HG3' ' HA ' ' A' ' 82' ' ' PRO . 5.9 mtt -64.95 154.7 36.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.853 -176.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.9 m -61.65 -7.39 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.135 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.62 -14.62 15.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.149 0.499 . . . . 0.0 110.307 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.83 -5.39 29.2 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 pt-20 -156.95 148.99 17.52 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.576 ' HA ' ' HG3' ' A' ' 77' ' ' MET . 2.7 Cg_exo -75.77 -139.58 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.123 2.549 . . . . 0.0 111.236 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.421 ' HB ' ' HE1' ' A' ' 89' ' ' PHE . 2.2 p -77.56 -100.12 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.464 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -119.68 172.83 7.4 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 171.324 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -46.6 81.76 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.81 69.24 0.72 Allowed Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 166.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.36 13.99 2.57 Favored Glycine 0 C--N 1.33 0.224 0 N-CA-C 114.271 0.468 . . . . 0.0 114.271 -170.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.441 ' CD ' HH12 ' A' ' 62' ' ' ARG . 20.3 mt-10 -91.91 73.43 5.66 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.464 ' HD1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -63.75 -178.29 0.29 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.773 -174.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.51 -92.33 2.09 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.567 ' OD2' ' HB2' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -122.13 -80.19 0.62 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.876 0.37 . . . . 0.0 110.086 177.765 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -48.13 2.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.08 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -141.09 10.88 2.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.632 177.267 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.766 ' HB3' HD13 ' A' ' 96' ' ' LEU . 10.9 mt-10 81.58 104.86 0.06 Allowed 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.486 1.114 . . . . 0.0 110.991 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.58 ' HG3' ' CZ ' ' A' ' 45' ' ' ARG . 1.7 ttm180 -76.87 -0.65 24.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.474 -1.239 . . . . 0.0 112.149 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.766 HD13 ' HB3' ' A' ' 94' ' ' GLU . 0.7 OUTLIER -32.02 154.67 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -171.738 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.649 ' O ' ' HA ' ' A' ' 43' ' ' VAL . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.755 ' HA ' HG22 ' A' ' 43' ' ' VAL . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.536 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.44 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.3 OUTLIER -108.45 -94.68 0.4 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.44 ' H ' ' HB ' ' A' ' 103' ' ' THR . 3.6 pt20 -164.07 59.46 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.069 0.462 . . . . 0.0 111.045 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.563 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -125.38 80.88 1.92 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.069 0.462 . . . . 0.0 110.967 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.92 -50.66 10.82 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.174 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.88 20.17 2.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.75 -177.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -86.73 5.13 37.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.476 0.655 . . . . 0.0 110.186 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -86.18 36.75 0.69 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.31 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.2 17.97 48.3 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.418 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.484 HG23 HD12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -105.66 -106.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.68 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.422 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 25.2 t70 -172.72 104.79 0.15 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.424 175.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.49 ' HB3' ' HE1' ' A' ' 105' ' ' PHE . 1.4 t70 -107.68 169.79 8.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.806 -178.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.164 -0.375 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.3 -38.44 65.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.258 0.551 . . . . 0.0 110.695 -178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mp -108.93 -142.3 0.38 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.923 176.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.492 HD21 ' OD1' ' A' ' 102' ' ' ASN . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.619 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.458 ' O ' ' HB ' ' A' ' 43' ' ' VAL . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.525 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.619 ' HA ' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.551 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.495 ' HB2' ' HA ' ' A' ' 105' ' ' PHE . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.406 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.771 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.42 HD23 HG21 ' A' ' 97' ' ' ILE . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.793 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' HG22 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.821 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' HB3' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.6 HE22 ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.793 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.519 ' HZ2' ' HB2' ' A' ' 46' ' ' ARG . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.771 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.886 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.683 HD23 HD21 ' A' ' 47' ' ' LEU . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.942 ' H ' HD13 ' A' ' 40' ' ' LEU . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.596 ' O ' ' HB2' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.537 ' OD1' ' HB3' ' A' ' 40' ' ' LEU . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 1.002 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.26 36.62 93.45 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.0 m -63.52 -72.09 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.74 -34.72 9.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.882 0.372 . . . . 0.0 110.025 173.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.942 HD13 ' H ' ' A' ' 32' ' ' SER . 15.3 mt -75.67 -128.28 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.805 177.278 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 93.38 49.61 2.55 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -176.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.496 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 51.85 71.07 0.48 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.305 0.574 . . . . 0.0 111.532 -176.096 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.75 HG22 HD22 ' A' ' 40' ' ' LEU . 1.8 m -86.54 6.49 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.345 -175.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.482 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . 156.88 6.15 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 118.414 -1.85 . . . . 0.0 115.749 168.106 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER 171.17 -78.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.81 1.305 . . . . 0.0 113.66 175.478 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.787 ' HA ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -126.73 -169.87 2.1 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -164.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER 176.77 -173.87 0.11 Allowed 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -174.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.737 ' H ' HD23 ' A' ' 47' ' ' LEU . 2.1 t80 -77.71 92.13 4.13 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 166.251 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.821 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.666 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.413 HD23 ' HD2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 1.002 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.612 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.675 HH21 ' HB3' ' A' ' 91' ' ' ASP . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.476 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.666 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -67.36 -40.85 85.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.599 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -72.42 -15.07 61.83 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.358 -177.46 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -22.24 60.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.061 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -120.89 -49.19 2.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.858 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.49 33.53 2.64 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.322 -174.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.599 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -76.92 -83.81 0.49 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.109 -1.043 . . . . 0.0 111.317 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.494 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -101.68 -120.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.494 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -115.44 -1.52 21.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.091 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.52 -119.97 6.32 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.544 -177.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 59.59 -99.55 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.658 0.383 . . . . 0.0 111.57 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.5 mtt -83.82 -21.38 32.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.994 0.425 . . . . 0.0 110.655 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.97 96.54 1.04 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.958 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.01 126.8 40.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.101 0.477 . . . . 0.0 110.609 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.653 ' HA3' ' HD1' ' A' ' 89' ' ' PHE . . . 177.31 177.8 46.48 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -178.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.418 ' O ' ' HA ' ' A' ' 82' ' ' PRO . . . 112.61 172.3 18.66 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.708 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -146.52 130.56 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.847 0.356 . . . . 0.0 110.838 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.467 HG21 HD13 ' A' ' 84' ' ' LEU . 48.2 t -87.52 112.89 24.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.805 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.454 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -55.8 153.0 8.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.098 -176.299 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.454 ' HB ' ' O ' ' A' ' 77' ' ' MET . 76.1 t 75.62 -55.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.856 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 -35.19 24.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.998 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.96 49.07 9.04 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.595 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 76' ' ' VAL . 1.8 mt-10 -106.11 106.67 57.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.786 0.327 . . . . 0.0 110.259 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 84.9 Cg_endo -88.5 -172.59 0.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 112.99 -175.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 45.26 63.8 1.63 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.467 HD13 HG21 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -84.5 147.42 27.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.393 177.066 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -15.93 62.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.868 -175.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.36 -27.6 71.89 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.33 10.09 85.09 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.489 178.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -92.66 86.06 5.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 178.061 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.653 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 0.0 OUTLIER -73.16 143.37 47.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.5 . . . . 0.0 110.502 -179.173 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 175.84 109.31 0.24 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.109 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.675 ' HB3' HH21 ' A' ' 57' ' ' ARG . 1.0 OUTLIER -78.21 -92.02 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.481 0.64 . . . . 0.0 110.798 -178.032 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -124.6 -52.41 1.7 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.275 0.56 . . . . 0.0 109.95 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -140.92 25.24 2.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.12 177.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.535 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 2.8 mm-40 60.16 40.26 18.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.764 -170.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.675 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 1.0 OUTLIER -161.63 163.56 29.86 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.747 -172.637 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.775 HD21 HG12 ' A' ' 22' ' ' ILE . 0.1 OUTLIER -87.84 20.12 3.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.821 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.45 ' N ' HG21 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.406 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.551 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.41 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 1.2 m -78.36 -81.11 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.41 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -155.62 -67.68 0.12 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.074 174.109 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.495 ' HA ' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -177.14 127.97 0.16 Allowed 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.793 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.34 -42.15 90.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.447 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . . . -94.11 58.6 2.55 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.216 172.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -71.37 -15.13 62.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.338 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -64.84 -35.12 80.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.607 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.91 -147.13 20.3 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.009 -0.615 . . . . 0.0 111.749 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.18 -38.54 3.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.04 0.447 . . . . 0.0 110.412 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -106.02 162.26 13.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.924 176.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.447 ' HA ' ' HB3' ' A' ' 107' ' ' ALA . 4.1 t0 -85.09 99.39 11.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.239 0.542 . . . . 0.0 110.853 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.311 -0.852 . . . . 0.0 109.226 178.306 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.65 155.85 36.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.785 0.326 . . . . 0.0 110.769 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.38 -177.64 4.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.556 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.418 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.718 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.718 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.429 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.428 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.938 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.437 ' HB2' HG22 ' A' ' 97' ' ' ILE . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.577 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.938 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.431 ' O ' ' HA3' ' A' ' 41' ' ' GLY . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.513 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.935 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.413 HD22 ' HB3' ' A' ' 59' ' ' ASP . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.935 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.1 22.35 74.22 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -86.64 -98.48 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.828 0.314 . . . . 0.0 110.745 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -172.59 110.04 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.617 0.246 . . . . 0.0 110.958 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.33 -9.61 59.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.139 0.495 . . . . 0.0 110.056 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 28' ' ' GLU . . . -81.88 -6.68 88.77 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.675 174.675 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -97.94 -67.13 0.86 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.404 ' H ' HG11 ' A' ' 43' ' ' VAL . 1.3 p -102.56 100.03 9.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.12 172.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.53 74.21 0.19 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.463 -173.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.442 ' HG3' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -88.13 -26.21 22.59 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.48 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.584 ' HB2' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -136.21 -173.64 3.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.663 175.805 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.815 ' HB2' HG12 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -161.28 127.8 3.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.951 0.405 . . . . 0.0 110.845 178.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.693 ' HE1' ' HG2' ' A' ' 92' ' ' GLU . 80.1 t80 -122.42 134.97 54.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.341 174.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.851 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.417 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.444 HD22 ' H ' ' A' ' 52' ' ' GLY . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.444 ' H ' HD22 ' A' ' 51' ' ' LEU . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.417 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.591 HD22 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.655 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.657 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.655 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.96 -38.4 78.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.657 ' HB2' ' O ' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -61.85 -30.31 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.225 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.506 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -83.61 -21.48 32.54 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -175.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -104.34 -60.64 1.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.605 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.62 -38.41 4.99 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.307 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.567 ' HA2' ' HA ' ' A' ' 61' ' ' LEU . . . 26.15 42.99 0.02 OUTLIER Glycine 0 N--CA 1.467 0.733 0 N-CA-C 116.261 1.264 . . . . 0.0 116.261 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.09 -42.25 97.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.041 0.448 . . . . 0.0 110.445 177.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -87.29 7.79 79.38 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.958 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.615 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -94.02 -60.36 1.13 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.58 -85.33 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.267 0.627 . . . . 0.0 111.942 175.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.581 ' O ' ' HG3' ' A' ' 77' ' ' MET . 5.2 mtm -68.53 -54.84 14.17 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.99 -76.43 1.52 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.022 176.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.25 71.58 2.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 110.944 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 69.36 -107.02 1.96 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.429 -0.669 . . . . 0.0 111.429 -177.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.29 -15.86 16.43 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 174.522 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.39 119.92 20.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 0.0 110.482 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.412 ' HA ' ' HA ' ' A' ' 70' ' ' MET . 2.3 t -75.35 123.86 32.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.524 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.585 ' HB3' ' HB3' ' A' ' 81' ' ' GLU . 3.1 mtm -64.93 159.8 22.03 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.469 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.446 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -90.04 -123.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.648 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.446 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 1.4 t -111.82 -16.86 8.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.921 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.13 67.81 0.22 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.585 ' HB3' ' HB3' ' A' ' 77' ' ' MET . 0.0 OUTLIER -108.27 104.77 54.95 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 121.068 0.461 . . . . 0.0 111.905 -172.545 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.23 -152.38 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.534 2.822 . . . . 0.0 111.885 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.07 85.66 4.27 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 173.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 156.1 15.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.831 -173.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.36 -40.02 95.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.841 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.45 -135.17 7.74 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 172.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 53.04 56.08 20.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.553 177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.52 83.65 5.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.904 0.383 . . . . 0.0 110.459 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.28 159.43 23.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.421 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.401 ' O ' ' HG2' ' A' ' 57' ' ' ARG . . . -112.11 -118.07 3.63 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.711 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -151.43 -115.33 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.693 ' HG2' ' HE1' ' A' ' 48' ' ' TYR . 8.7 pt-20 -166.52 -54.47 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 175.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.505 ' H ' ' HG3' ' A' ' 92' ' ' GLU . 11.8 t70 -140.72 -41.8 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.998 174.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.584 ' OE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 68.8 161.75 0.2 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 124.011 0.819 . . . . 0.0 111.846 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.508 ' HB2' ' HE1' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -120.37 -16.84 8.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.554 -177.605 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.41 ' HA ' ' N ' ' A' ' 47' ' ' LEU . 1.8 mp 61.38 -171.14 0.15 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.378 0.424 . . . . 0.0 110.815 -177.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.815 HG12 ' HB2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.425 ' HD2' HD23 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.75 HD11 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.567 ' HG3' ' HB2' ' A' ' 108' ' ' ALA . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m -51.21 -51.3 55.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.14 -40.79 59.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.085 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.403 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -138.1 87.9 2.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.814 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.713 ' HB3' ' HA ' ' A' ' 112' ' ' ASP . 9.3 t70 -99.72 -113.11 0.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.614 178.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 61.44 29.63 18.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.77 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.567 ' HB2' ' HG3' ' A' ' 101' ' ' GLU . . . -106.66 -82.41 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.713 178.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -83.49 -34.38 25.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -104.42 170.24 18.21 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.627 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.448 ' O ' ' HB3' ' A' ' 112' ' ' ASP . 1.2 mm -92.15 56.1 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.713 ' HA ' ' HB3' ' A' ' 106' ' ' ASP . 12.7 t70 75.01 -58.47 0.57 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.969 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -85.03 90.99 7.97 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.573 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 . . . . . 0 C--O 1.247 0.952 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.152 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.76 0 N-CA-C 112.194 -0.363 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -90.99 136.69 32.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.905 -0.173 . . . . 0.0 110.574 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -73.2 -105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.095 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.594 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.511 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.468 ' HG2' HG23 ' A' ' 5' ' ' THR . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.528 ' HA ' HG22 ' A' ' 5' ' ' THR . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.482 ' HB2' ' CD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.581 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.624 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.418 ' O ' ' HB2' ' A' ' 26' ' ' TRP . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.962 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.425 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.816 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.445 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.702 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.962 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.797 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.538 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.47 ' SG ' ' HA ' ' A' ' 40' ' ' LEU . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.686 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.878 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.09 18.3 72.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.47 -105.87 0.15 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.071 0.435 . . . . 0.0 109.894 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -155.44 38.37 0.39 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.674 0.273 . . . . 0.0 110.375 177.419 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.481 HD13 HD23 ' A' ' 47' ' ' LEU . 0.1 OUTLIER 57.12 -105.16 0.25 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.585 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.446 ' H ' ' HB3' ' A' ' 40' ' ' LEU . . . -95.23 2.17 65.37 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.349 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.8 OUTLIER 70.97 -61.92 0.47 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.822 0.849 . . . . 0.0 111.539 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.491 ' H ' HG21 ' A' ' 43' ' ' VAL . 0.1 OUTLIER -96.59 174.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.071 176.313 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.13 52.37 4.62 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.234 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HG3' ' H ' ' A' ' 46' ' ' ARG . 1.8 ptp180 -91.52 -69.47 0.74 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' H ' ' HG3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -135.31 131.11 36.08 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.481 HD23 HD13 ' A' ' 40' ' ' LEU . 0.2 OUTLIER -139.93 123.73 17.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.222 0.534 . . . . 0.0 110.981 -177.164 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.464 ' CE2' ' HB3' ' A' ' 94' ' ' GLU . 21.9 m-85 -100.28 154.82 18.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.371 176.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.539 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.526 ' HD3' HD12 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.526 HD12 ' HD3' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.593 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.472 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.878 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -71.99 -31.51 66.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.716 HD22 ' HA3' ' A' ' 73' ' ' GLY . 6.9 tp -64.9 -16.46 63.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.62 -178.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.31 -25.15 64.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.108 0.48 . . . . 0.0 110.592 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.3 -46.37 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.672 -177.286 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.29 3.59 58.18 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.959 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.589 ' HA3' HD13 ' A' ' 61' ' ' LEU . . . -134.23 42.79 1.32 Allowed Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.91 42.41 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.43 -34.79 90.91 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.62 -28.67 8.79 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.425 173.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.43 ' CE1' ' HB2' ' A' ' 72' ' ' SER . 0.2 OUTLIER -124.45 164.01 20.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.548 0.689 . . . . 0.0 111.675 -176.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mtt -78.99 -22.57 45.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.444 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.14 -36.81 72.1 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.43 ' HB2' ' CE1' ' A' ' 69' ' ' HIS . 11.9 m -142.37 103.39 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.763 0.316 . . . . 0.0 110.53 178.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.716 ' HA3' HD22 ' A' ' 61' ' ' LEU . . . -73.14 -29.01 65.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.241 -0.981 . . . . 0.0 111.903 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.79 25.26 65.21 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.604 176.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.523 ' O ' ' HB3' ' A' ' 82' ' ' PRO . 6.2 t70 -78.37 95.83 5.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -127.95 110.68 22.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.489 0.662 . . . . 0.0 110.955 -175.196 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.599 ' HE1' ' HB3' ' A' ' 91' ' ' ASP . 3.6 mtt -80.86 103.57 10.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.972 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.408 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 2.0 t 53.96 -108.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 -176.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.408 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -129.52 33.49 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.153 0.501 . . . . 0.0 110.208 177.772 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.42 -2.08 87.16 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 113.139 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.41 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 4.2 mt-10 58.31 96.84 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 122.839 0.455 . . . . 0.0 111.635 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.523 ' HB3' ' O ' ' A' ' 75' ' ' ASP . 18.8 Cg_endo -63.32 162.17 28.0 Favored 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 122.986 2.457 . . . . 0.0 113.445 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.81 71.1 6.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.401 175.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -67.99 99.29 0.84 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.974 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.72 34.58 3.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.355 -178.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.64 59.89 2.42 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.332 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 83.63 -42.92 3.09 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.87 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.24 81.82 8.26 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.89 0.376 . . . . 0.0 111.902 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -175.7 5.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.384 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -176.13 102.45 0.17 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.599 ' HB3' ' HE1' ' A' ' 77' ' ' MET . 4.2 p-10 -67.56 -92.45 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -171.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.484 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -159.02 -34.6 0.06 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.069 0.461 . . . . 0.0 110.476 -176.416 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.417 ' C ' ' H ' ' A' ' 95' ' ' ARG . 7.0 t0 -87.99 14.91 8.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.468 -176.228 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.464 ' HB3' ' CE2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -79.94 32.86 0.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.638 0.732 . . . . 0.0 110.987 176.625 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.495 ' HB2' ' H ' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -110.14 -138.09 0.37 Allowed 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.135 -177.851 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.816 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER 56.74 55.04 6.63 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 171.385 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.466 HG13 ' C ' ' A' ' 96' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.624 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t -124.41 -127.44 0.25 Allowed 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -112.53 63.51 0.63 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.482 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -85.48 70.92 10.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.14 -178.188 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -90.98 -81.92 0.3 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.033 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.509 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . 57.03 35.28 26.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.156 -178.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -78.83 125.65 29.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.543 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -66.97 -16.92 64.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.217 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.99 -40.71 58.62 Favored Glycine 0 C--N 1.335 0.475 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 176.037 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.411 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 0.4 OUTLIER -109.34 -89.9 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.198 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.411 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 2.7 t0 -173.95 174.68 2.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.997 171.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.509 ' HA ' ' HA ' ' A' ' 107' ' ' ALA . 1.5 t70 -81.88 114.21 20.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.892 0.377 . . . . 0.0 110.276 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.071 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.33 167.55 11.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.849 0.357 . . . . 0.0 110.637 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.418 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -100.97 -173.91 2.49 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 176.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.451 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.496 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.855 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.855 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.496 ' HA ' HG21 ' A' ' 5' ' ' THR . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.614 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.601 ' O ' HD23 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.601 HD23 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.995 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.787 HG12 HD13 ' A' ' 47' ' ' LEU . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.488 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.425 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.995 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.474 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.554 HD23 HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.536 ' C ' HD11 ' A' ' 40' ' ' LEU . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.911 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.431 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.911 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.04 10.75 51.36 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.522 ' CB ' ' HB2' ' A' ' 32' ' ' SER . 2.0 m -81.54 -75.3 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.885 0.343 . . . . 0.0 111.46 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.422 ' NE ' ' SG ' ' A' ' 30' ' ' CYS . 15.5 ttm-85 -159.37 -99.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.12 178.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.741 ' HB3' ' HB2' ' A' ' 54' ' ' LYS . 1.2 mp 32.85 84.36 0.02 OUTLIER 'General case' 0 C--N 1.346 0.427 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.87 -98.26 0.78 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.399 -0.905 . . . . 0.0 111.964 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.426 ' OE1' ' HH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER 4.19 -98.52 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.673 1.589 . . . . 0.0 114.758 177.767 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.406 ' H ' ' HB2' ' A' ' 42' ' ' GLU . 2.9 p -152.62 176.54 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.725 0.298 . . . . 0.0 111.563 -174.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.25 -173.2 37.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.227 179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -148.97 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.844 0.322 . . . . 0.0 111.055 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 84.63 3.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.787 HD13 HG12 ' A' ' 22' ' ' ILE . 0.6 OUTLIER 176.95 142.83 0.08 Allowed 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -80.96 96.38 7.07 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 1.012 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.415 ' HG3' ' CD2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 1.012 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.415 ' CD2' ' HG3' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.474 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.436 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 62' ' ' ARG . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -70.01 -33.88 72.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.01 -19.3 65.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.96 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.658 ' NH2' ' HA ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -66.95 -27.96 67.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 178.03 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.45 -60.17 1.81 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -176.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.06 22.19 30.38 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.963 -0.637 . . . . 0.0 113.058 -177.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -104.63 -107.56 3.22 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.816 177.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.93 -102.66 0.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.811 0.338 . . . . 0.0 110.741 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -100.23 -19.14 19.73 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.954 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.497 ' HA2' ' HA ' ' A' ' 62' ' ' ARG . . . 125.29 -15.59 7.24 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -61.9 -177.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.331 0.586 . . . . 0.0 111.75 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.658 ' HA ' ' NH2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.49 -74.84 0.45 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.482 178.588 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.466 ' HA3' ' HA3' ' A' ' 86' ' ' GLY . . . 69.14 -59.5 0.57 Allowed Glycine 0 CA--C 1.523 0.546 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.016 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.569 ' N ' ' H ' ' A' ' 87' ' ' GLY . 1.4 m 61.34 96.38 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.591 0.756 . . . . 0.0 112.287 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.883 ' HA3' ' H ' ' A' ' 85' ' ' MET . . . 146.11 -93.69 0.16 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.574 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . 0.998 ' HA2' ' HG2' ' A' ' 88' ' ' GLU . . . 170.42 -137.82 4.65 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -177.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -82.68 141.7 32.25 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 174.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -78.52 94.9 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.069 0.461 . . . . 0.0 110.702 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.424 ' H ' ' HG3' ' A' ' 77' ' ' MET . 0.0 OUTLIER -94.14 173.79 7.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.702 179.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.0 m -70.93 -18.94 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.148 0.499 . . . . 0.0 110.183 175.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.82 25.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.716 175.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -66.93 -52.5 32.7 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.26 -178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.754 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 65.7 mm-40 61.93 174.62 0.06 OUTLIER Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 122.52 0.328 . . . . 0.0 111.07 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.754 ' HD2' ' HB3' ' A' ' 81' ' ' GLU . 15.5 Cg_exo -40.44 -54.32 2.31 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 123.347 2.698 . . . . 0.0 113.828 -177.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.37 -47.11 18.77 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.043 -0.98 . . . . 0.0 113.099 -177.004 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.657 ' HA ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 mt -102.16 102.82 13.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.803 0.335 . . . . 0.0 111.899 -175.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.883 ' H ' ' HA3' ' A' ' 73' ' ' GLY . 12.0 ttp -126.19 -46.18 1.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.889 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.466 ' HA3' ' HA3' ' A' ' 71' ' ' GLY . . . -148.79 -80.53 0.03 OUTLIER Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.354 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.569 ' H ' ' N ' ' A' ' 72' ' ' SER . . . -56.65 107.57 0.95 Allowed Glycine 0 C--O 1.223 -0.548 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 -175.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.998 ' HG2' ' HA2' ' A' ' 74' ' ' GLY . 0.9 OUTLIER -72.22 109.61 6.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -171.114 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -106.26 159.7 15.92 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 169.405 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 178.47 57.79 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.088 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.98 -87.87 0.59 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.215 0.531 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.449 ' HG3' ' H ' ' A' ' 93' ' ' ASP . 1.1 pt-20 -137.76 -75.37 0.4 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.278 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 96' ' ' LEU . 2.4 t0 -140.99 26.24 2.05 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.571 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.436 ' HG3' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 36.81 -108.32 0.05 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.261 1.024 . . . . 0.0 111.7 -176.213 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.527 HH21 ' HA ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -90.57 81.49 5.9 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 173.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.773 ' HB3' ' HB3' ' A' ' 93' ' ' ASP . 0.2 OUTLIER -75.21 113.3 12.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.465 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.547 ' HB ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.572 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.448 HD21 ' HE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.421 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m -61.4 -51.09 70.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -82.66 54.15 2.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.375 -0.829 . . . . 0.0 109.891 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.614 ' CD1' ' HB2' ' A' ' 16' ' ' ARG . 9.8 t80 -58.37 -63.94 1.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.429 -177.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.959 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 33.3 t70 48.74 -83.59 0.01 OUTLIER 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.537 1.135 . . . . 0.0 112.413 176.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 66.09 29.43 9.94 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.713 -1.585 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -123.07 -48.72 1.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.803 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -98.7 -36.01 9.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.336 173.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.1 -117.89 1.3 Allowed Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.407 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -83.05 1.83 3.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 0.0 110.196 176.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -94.15 78.42 4.02 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.25 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.959 ' HA ' ' HB2' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -55.42 139.42 43.43 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.695 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.269 178.774 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.615 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.25 159.02 18.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.608 0.204 . . . . 0.0 110.705 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.13 -109.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.461 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.6 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.565 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.477 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.844 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.608 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.477 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.608 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.6 ' HA ' HG23 ' A' ' 5' ' ' THR . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.526 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.491 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.689 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.607 ' HG ' ' HG3' ' A' ' 99' ' ' ARG . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.535 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.507 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.507 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.89 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.45 ' HA ' ' HD3' ' A' ' 39' ' ' ARG . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.89 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 1.056 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.62 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.746 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.15 59.18 5.16 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.423 ' HB2' ' H ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -84.06 -83.23 0.15 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 177.706 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.45 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.8 OUTLIER -178.14 114.46 0.08 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.497 177.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -116.21 74.51 0.9 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.52 45.69 1.13 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.196 -173.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.494 ' OE2' ' HB3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -95.88 -157.87 0.61 Allowed 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.332 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -127.26 7.29 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.261 177.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.23 79.69 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.857 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.545 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -158.31 -93.76 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.171 0.485 . . . . 0.0 110.451 178.601 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.476 ' HG3' ' CG ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -103.34 69.11 0.99 Allowed 'General case' 0 C--N 1.321 -0.669 0 O-C-N 122.188 -0.32 . . . . 0.0 110.874 -179.708 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.771 ' HG ' HG12 ' A' ' 97' ' ' ILE . 1.1 tm? -117.89 117.02 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.035 0.445 . . . . 0.0 110.055 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.719 ' HE1' ' HA ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -138.68 161.57 36.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.538 ' HB2' HD23 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.466 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.466 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.844 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 1.056 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.478 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.746 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' CE2' HD11 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -73.88 -40.15 63.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.753 HD13 ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -73.05 -20.06 61.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 178.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.539 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.54 -30.7 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.215 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.68 -47.96 2.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.54 -178.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.35 20.35 46.89 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.535 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.753 ' HA3' HD13 ' A' ' 61' ' ' LEU . . . -122.32 -89.17 0.96 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.78 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.492 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -90.2 -121.06 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 176.322 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.492 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -123.79 -54.79 0.19 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.347 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -148.86 -6.24 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.539 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -79.07 -145.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.239 0.542 . . . . 0.0 111.398 -178.475 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.47 -66.64 0.89 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.183 -176.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.499 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . 112.92 -39.52 2.83 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -174.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.492 ' HA ' ' CZ ' ' A' ' 89' ' ' PHE . 51.7 m -70.29 104.41 2.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.09 128.58 9.13 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.558 -174.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 -74.03 0.51 Allowed Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -147.28 160.55 42.37 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 173.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.87 149.67 4.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.761 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 40.2 mtp -67.56 97.87 0.63 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.9 0.381 . . . . 0.0 110.719 -176.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.3 p -123.2 -17.93 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.352 -178.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -104.29 13.78 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.403 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.434 ' HA2' ' HD3' ' A' ' 45' ' ' ARG . . . 84.45 -57.62 5.02 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.34 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.36 87.76 52.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.761 ' HG3' ' HA ' ' A' ' 77' ' ' MET . 92.3 Cg_endo -95.74 -161.44 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.339 2.692 . . . . 0.0 111.571 178.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 140.45 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.635 HD21 ' CD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -111.66 102.4 10.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.543 -175.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.82 7.94 44.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.437 0.637 . . . . 0.0 110.65 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -138.91 -96.69 0.36 Allowed Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.582 ' HA3' HD22 ' A' ' 61' ' ' LEU . . . -72.54 121.48 8.07 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.404 173.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.403 ' HA ' HD11 ' A' ' 84' ' ' LEU . 2.7 mt-10 -84.88 84.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 122.413 -0.463 . . . . 0.0 109.905 -178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.635 ' CD2' HD21 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -69.72 153.79 42.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.136 -174.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.473 ' HA3' ' HB3' ' A' ' 93' ' ' ASP . . . -127.38 87.74 0.33 Allowed Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.719 ' HA ' ' HE1' ' A' ' 48' ' ' TYR . 11.6 p-10 -58.76 -63.06 1.43 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.297 0.57 . . . . 0.0 111.286 -176.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.445 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.97 -24.47 43.83 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.22 178.192 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.473 ' HB3' ' HA3' ' A' ' 90' ' ' GLY . 20.9 t70 -67.7 -27.49 66.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.904 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.422 ' HB3' ' H ' ' A' ' 95' ' ' ARG . 1.3 mm-40 -78.56 -102.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 179.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.521 ' HB3' HD13 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.0 160.99 36.93 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.025 0.44 . . . . 0.0 110.936 -176.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.36 -176.09 3.22 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.771 HG12 ' HG ' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.689 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.665 ' HB3' ' HZ ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.461 ' OD1' HD12 ' A' ' 4' ' ' LEU . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m -109.21 -121.94 0.26 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.408 ' HA ' ' HB3' ' A' ' 108' ' ' ALA . 2.6 mt-30 -139.84 84.79 2.0 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -178.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.665 ' HZ ' ' HB3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -53.41 -83.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.171 -175.221 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -110.3 -70.94 0.78 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.95 0.405 . . . . 0.0 110.059 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.11 -35.54 8.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.405 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 104' ' ' GLN . . . 64.99 -69.48 0.1 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.025 0.828 . . . . 0.0 112.045 178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -93.33 3.42 55.64 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.169 0.509 . . . . 0.0 110.346 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.44 167.3 20.1 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.867 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -87.52 -27.89 5.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.017 0.437 . . . . 0.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -88.95 56.91 3.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.657 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -89.2 116.61 27.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.906 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.495 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.42 ' HA2' ' HA3' ' A' ' 14' ' ' GLY . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 m -85.18 178.37 7.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.718 0.259 . . . . 0.0 110.684 178.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -25.96 67.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -175.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.488 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.478 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.488 ' HA ' HG21 ' A' ' 5' ' ' THR . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.42 ' HA3' ' HA2' ' A' ' 1' ' ' GLY . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.878 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.721 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.488 ' HB1' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.721 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.46 ' C ' ' HB2' ' A' ' 6' ' ' CYS . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.717 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.717 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.4 ' HB3' HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.616 HD21 ' HB3' ' A' ' 59' ' ' ASP . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.02 -33.21 5.19 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.551 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -70.23 -73.77 0.16 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.761 0.315 . . . . 0.0 110.445 -179.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.551 ' HD3' ' O ' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -158.9 -146.79 0.15 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.517 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.792 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 53.0 mt -96.67 111.62 23.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 175.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.84 -43.23 5.48 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.688 -174.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.937 ' HG3' ' HG2' ' A' ' 58' ' ' ARG . 10.7 mm-40 -106.33 11.75 30.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.648 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.792 ' HB ' ' HB3' ' A' ' 40' ' ' LEU . 81.5 t -117.84 96.2 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.788 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.78 7.01 25.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.402 -177.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.79 -33.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.502 0.321 . . . . 0.0 110.5 174.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.548 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -106.84 122.44 46.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.503 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.62 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.4 OUTLIER -95.81 113.88 25.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -178.549 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.548 ' CE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -107.05 91.4 3.64 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.544 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.439 ' HD3' HD13 ' A' ' 51' ' ' LEU . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' N ' HD21 ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.559 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.704 ' HB3' ' HB2' ' A' ' 42' ' ' GLU . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.421 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.937 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.616 ' HB3' HD21 ' A' ' 35' ' ' LEU . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.559 ' HB2' HD23 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -66.59 -39.52 88.46 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.486 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.9 OUTLIER -78.54 0.02 27.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.578 177.963 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.59 -21.76 23.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.063 0.458 . . . . 0.0 110.544 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.96 -51.2 2.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.612 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.32 37.9 3.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.471 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.486 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -140.93 43.32 1.12 Allowed Glycine 0 N--CA 1.444 -0.777 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 -176.694 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.42 41.29 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.26 -34.67 2.08 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.61 5.7 88.2 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.329 -0.463 . . . . 0.0 112.965 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 8.6 m170 -120.53 -159.84 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 122.79 -0.241 . . . . 0.0 110.385 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.72 -45.52 92.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.661 179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.545 ' HA2' HD21 ' A' ' 84' ' ' LEU . . . 115.81 8.87 13.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.164 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 80.07 0.88 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.263 0.554 . . . . 0.0 110.652 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.47 172.33 38.87 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.607 -174.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 153.11 -30.74 0.8 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -74.73 156.47 36.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.026 175.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.28 113.5 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.827 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.439 ' H ' ' HG3' ' A' ' 77' ' ' MET . 0.3 OUTLIER -77.31 99.25 5.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.568 -176.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -79.96 1.48 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -13.29 10.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.984 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.27 -53.26 4.82 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.867 -0.683 . . . . 0.0 111.948 -178.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -72.33 141.62 83.53 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-O 120.517 0.199 . . . . 0.0 110.488 177.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -52.24 -64.79 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.285 2.657 . . . . 0.0 112.936 -178.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 58.35 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.249 178.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.545 HD21 ' HA2' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -80.46 98.78 7.69 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.99 0.424 . . . . 0.0 110.306 179.495 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.39 34.9 1.54 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.098 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 66.2 77.71 0.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.586 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.91 -71.02 2.92 Favored Glycine 0 C--O 1.221 -0.675 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.949 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.93 79.59 9.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 117.07 0.435 . . . . 0.0 111.093 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -84.97 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.749 0.785 . . . . 0.0 109.741 177.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.83 41.8 1.46 Allowed Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.837 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -76.95 0.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.109 0.48 . . . . 0.0 110.437 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -65.32 -18.29 65.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.841 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -101.02 21.81 13.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.452 178.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.05 162.41 16.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.584 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.424 ' HB3' ' HE1' ' A' ' 49' ' ' TYR . 3.8 ttm105 -80.75 93.06 6.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.434 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.3 mt -79.02 156.34 28.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.072 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.523 HG12 ' HB2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.878 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.469 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.497 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -96.85 0.44 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -174.49 96.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.083 -0.962 . . . . 0.0 108.615 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.413 ' HB3' ' HD3' ' A' ' 16' ' ' ARG . 1.8 t80 -157.7 -84.6 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.705 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 26.6 t0 24.86 -86.7 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.171 1.788 . . . . 0.0 113.475 -175.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.935 ' HB3' ' HB ' ' A' ' 111' ' ' ILE . . . -159.76 35.04 0.19 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.363 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.609 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . -65.45 -8.16 17.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.503 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -64.87 -25.58 67.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.195 177.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 152.9 -21.94 0.79 Allowed Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.357 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.935 ' HB ' ' HB3' ' A' ' 107' ' ' ALA . 19.0 mm -68.07 -37.35 78.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 0.0 110.854 -179.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.95 69.51 0.19 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.49 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.609 ' HA ' ' HA ' ' A' ' 108' ' ' ALA . 0.5 OUTLIER -82.6 115.8 21.73 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.487 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.596 -177.407 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -112.67 -125.89 0.28 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.31 174.95 7.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.553 HD11 ' CZ ' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.442 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.483 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.483 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' HB3' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.463 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.623 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.65 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.858 HD21 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.493 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.656 HG12 HD22 ' A' ' 47' ' ' LEU . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.549 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.427 ' HA ' ' CD1' ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.879 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.701 ' HG ' HD12 ' A' ' 40' ' ' LEU . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.489 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.543 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.72 45.53 88.42 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.59 -81.96 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -152.53 -162.16 1.45 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.701 HD12 ' HG ' ' A' ' 31' ' ' LEU . 10.7 mt -119.47 144.54 46.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.829 0.347 . . . . 0.0 110.326 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.66 42.96 2.23 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.168 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.464 ' HB3' ' C ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -74.83 126.96 32.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.792 -0.204 . . . . 0.0 110.812 -178.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -143.71 4.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 177.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.41 10.05 0.07 OUTLIER Glycine 0 CA--C 1.528 0.887 0 C-N-CA 118.559 -1.782 . . . . 0.0 116.183 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.421 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 6.8 ttm180 -109.41 -98.58 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 119.499 1.649 . . . . 0.0 112.49 -173.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.697 ' HA ' HD23 ' A' ' 96' ' ' LEU . 2.6 ptm180 -148.19 154.96 40.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.943 -173.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.889 HD13 ' HG2' ' A' ' 95' ' ' ARG . 0.9 OUTLIER -69.65 108.54 3.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.623 -178.422 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.502 ' H ' ' HG3' ' A' ' 95' ' ' ARG . 3.8 m-85 -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.951 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.501 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.501 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.42 ' H ' ' HG3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.489 ' HA ' ' H ' ' A' ' 34' ' ' ASP . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.554 ' HA ' ' NH2' ' A' ' 95' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.633 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.78 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.543 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.633 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER -72.61 -33.56 66.76 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.468 HD12 ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -77.09 -69.61 0.52 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.037 176.399 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 -79.39 0.09 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.103 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.33 -35.36 2.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.78 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -140.52 -60.78 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.86 176.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -144.81 41.43 1.08 Allowed Glycine 0 C--O 1.226 -0.369 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.764 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 m 28.96 42.82 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.898 1.074 . . . . 0.0 113.898 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -117.48 -70.86 0.41 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.86 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.79 -4.9 57.97 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.336 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.32 159.91 14.7 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -51.64 52.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -86.6 102.89 2.77 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.848 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.479 ' CB ' ' HB2' ' A' ' 88' ' ' GLU . 0.6 OUTLIER -89.6 -163.8 1.06 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.634 0.254 . . . . 0.0 110.863 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.724 ' HA3' HD11 ' A' ' 84' ' ' LEU . . . -83.55 -87.51 0.81 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.667 -178.354 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.17 -143.58 25.2 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.372 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -101.4 95.96 6.84 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.558 0.694 . . . . 0.0 110.432 -179.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.46 175.11 10.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.887 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.5 mtt -56.23 135.55 53.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.942 0.401 . . . . 0.0 111.523 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.598 HG22 ' HA ' ' A' ' 82' ' ' PRO . 14.8 p -155.68 145.82 12.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.172 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.73 -42.65 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.952 0.406 . . . . 0.0 111.175 -177.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -156.53 -99.24 0.16 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.908 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -66.14 123.96 86.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.186 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.598 ' HA ' HG22 ' A' ' 78' ' ' VAL . 11.7 Cg_exo -69.33 144.95 58.1 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.212 1.941 . . . . 0.0 111.962 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -167.92 119.05 0.83 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.165 -178.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.724 HD11 ' HA3' ' A' ' 73' ' ' GLY . 1.3 mt -120.37 149.37 42.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.429 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.16 1.19 15.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.984 0.421 . . . . 0.0 110.635 -178.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -87.52 -99.48 0.88 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.914 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -135.31 -177.28 14.85 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-O 119.116 -0.824 . . . . 0.0 111.798 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.479 ' HB2' ' CB ' ' A' ' 72' ' ' SER . 1.8 mp0 12.24 78.49 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.22 1.408 . . . . 0.0 113.702 176.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.474 ' HD1' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-85 -72.71 -82.78 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.533 -173.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -153.87 98.41 0.18 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 0.5 OUTLIER -123.26 -82.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.958 -0.121 . . . . 0.0 111.039 -175.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.481 ' C ' ' H ' ' A' ' 94' ' ' GLU . 2.4 mp0 70.64 109.18 0.06 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.641 -168.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.454 ' CG ' HH12 ' A' ' 95' ' ' ARG . 28.0 t70 -70.08 38.06 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.028 -1.442 . . . . 0.0 112.175 -174.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.481 ' H ' ' C ' ' A' ' 92' ' ' GLU . 3.7 mm-40 -61.25 154.26 24.05 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.856 -176.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.889 ' HG2' HD13 ' A' ' 47' ' ' LEU . 2.3 ttm105 -166.85 -167.49 0.97 Allowed 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.692 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.697 HD23 ' HA ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -143.78 155.18 44.07 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.77 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.858 ' HB ' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.623 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.65 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.77 -86.42 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.94 -63.6 1.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.408 ' HB3' ' H ' ' A' ' 106' ' ' ASP . 0.4 OUTLIER -157.85 -121.37 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.45 ' HB3' ' OD2' ' A' ' 113' ' ' ASP . 17.8 t0 -154.56 -81.06 0.08 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.465 ' HB2' ' OD1' ' A' ' 113' ' ' ASP . . . -119.81 -78.21 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.297 171.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -166.54 -15.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.65 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . 30.8 t30 -82.68 -29.94 29.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.87 -122.69 6.86 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.014 178.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 10.6 mt -58.5 -58.14 7.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.982 0.42 . . . . 0.0 111.235 -176.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -93.21 66.71 4.08 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.45 174.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.65 ' HA ' ' HB3' ' A' ' 109' ' ' ASN . 1.3 t0 -78.31 165.76 23.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.879 -176.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.209 -178.349 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.968 -0.453 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.95 128.78 37.92 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.702 0.286 . . . . 0.0 110.75 -178.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt -79.06 174.16 11.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.515 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.586 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.455 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.455 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.586 ' HA ' HG21 ' A' ' 5' ' ' THR . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.458 ' HB3' ' CD1' ' A' ' 105' ' ' PHE . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.473 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.509 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.959 HD11 ' HA2' ' A' ' 41' ' ' GLY . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.895 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.591 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.789 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.895 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.789 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.862 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.46 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.862 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.526 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.608 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.82 HD23 HD21 ' A' ' 63' ' ' LEU . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.608 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.28 21.46 6.58 Favored Glycine 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.576 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -83.92 -101.99 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.271 0.535 . . . . 0.0 110.507 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.526 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -178.47 155.54 0.87 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 117.907 0.321 . . . . 0.0 111.037 179.708 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.742 HD21 HD11 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.91 164.87 27.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.837 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.959 ' HA2' HD11 ' A' ' 19' ' ' LEU . . . 168.8 48.48 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.754 -178.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.476 ' OE2' ' HD3' ' A' ' 46' ' ' ARG . 1.3 pm0 -139.85 -179.92 6.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 -178.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.684 ' HB ' ' H ' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -124.55 121.23 61.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 176.164 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 163.19 -167.9 37.7 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.116 -174.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.496 ' H ' ' HG3' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -80.89 44.71 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.461 0.648 . . . . 0.0 110.784 177.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.476 ' HD3' ' OE2' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -93.38 -168.18 1.86 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.941 178.397 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.742 HD11 HD21 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -22.26 118.78 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.519 ' CB ' ' HA ' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -109.54 131.25 55.24 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.667 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 1.064 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.457 HD11 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.457 ' H ' HD11 ' A' ' 51' ' ' LEU . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.588 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 1.064 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.588 HD21 ' HB2' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.6 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.527 ' HG2' HG22 ' A' ' 83' ' ' THR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.6 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.525 ' HE1' ' HA ' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -63.22 -37.02 85.61 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.435 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -66.03 -9.75 33.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.2 -176.751 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.71 -20.52 58.3 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.802 175.741 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.82 HD21 HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -116.83 -42.66 2.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.799 176.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.17 23.13 10.06 Favored Glycine 0 C--N 1.329 0.16 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.435 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -100.22 45.26 1.5 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.008 -0.596 . . . . 0.0 111.696 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -21.47 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -173.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.468 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -70.89 -10.77 68.61 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.678 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.76 -120.11 5.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.604 -0.331 . . . . 0.0 112.645 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -39.0 13.16 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.2 mtt -62.14 -57.27 12.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.45 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.468 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 60.51 45.89 95.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.21 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.411 ' HA ' ' HA3' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -107.45 54.78 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.047 0.451 . . . . 0.0 110.227 -178.774 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.543 ' H ' ' HE1' ' A' ' 89' ' ' PHE . . . -75.55 -50.58 7.99 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.957 -175.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.87 -70.57 2.71 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.651 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -135.59 106.54 6.65 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 175.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -112.31 113.96 45.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.283 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.8 mtp -71.36 98.06 1.71 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -168.22 -162.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.445 177.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 3.1 t -109.61 38.98 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 172.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.81 -72.08 1.27 Allowed Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.419 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.46 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 1.9 mt-10 62.28 79.58 0.27 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.525 ' HA ' ' HE1' ' A' ' 60' ' ' TYR . 4.4 Cg_endo -92.62 162.09 2.87 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.231 2.621 . . . . 0.0 113.388 -175.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.527 HG22 ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -77.51 165.76 23.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 88' ' ' GLU . 1.8 mp -66.65 99.0 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.03 -47.94 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.712 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -135.96 -78.23 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.024 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.411 ' HA3' ' HA ' ' A' ' 72' ' ' SER . . . -81.53 48.07 3.76 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.369 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.602 ' HB3' HD21 ' A' ' 84' ' ' LEU . 2.3 mp0 20.71 81.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.25 0 C-N-CA 125.285 1.434 . . . . 0.0 114.614 174.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.543 ' HE1' ' H ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -86.72 -151.62 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.84 175.539 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -179.96 108.16 0.23 Allowed Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.528 ' O ' ' HB2' ' A' ' 92' ' ' GLU . 23.0 p-10 -70.89 -59.25 2.9 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.861 0.362 . . . . 0.0 110.415 -177.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.528 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 4.7 mt-10 77.32 -5.53 2.14 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.796 -176.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.449 ' OD2' ' HG ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -84.4 22.38 1.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.844 171.415 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.519 ' HA ' ' CB ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -78.84 61.95 3.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.093 -0.958 . . . . 0.0 112.045 -171.457 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.582 ' HB3' ' HD1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -89.17 86.12 6.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.013 0.435 . . . . 0.0 109.872 173.546 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 pp -78.52 174.2 11.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.353 -178.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.591 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.684 ' H ' ' HB ' ' A' ' 43' ' ' VAL . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.471 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.8 m -144.66 -123.83 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.23 40.91 1.08 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.184 0.516 . . . . 0.0 110.129 176.236 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.458 ' CD1' ' HB3' ' A' ' 16' ' ' ARG . 7.5 t80 -78.81 -70.22 0.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.209 -177.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' ' 107' ' ' ALA . 23.8 t0 -53.64 -77.81 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.288 0.566 . . . . 0.0 110.492 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.405 ' H ' ' HB3' ' A' ' 106' ' ' ASP . . . -167.89 36.78 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.424 174.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 112' ' ' ASP . . . -100.59 124.35 46.04 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.842 -176.209 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -124.84 22.87 8.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.161 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.96 -49.53 0.86 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.058 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.7 50.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.441 ' O ' ' HA ' ' A' ' 108' ' ' ALA . 1.5 t70 61.49 -160.01 0.31 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.845 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.28 95.58 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.321 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.77 154.08 39.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.743 0.306 . . . . 0.0 110.723 179.43 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.501 ' N ' HD21 ' A' ' 3' ' ' LEU . 0.3 OUTLIER -76.83 170.41 16.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.431 -177.421 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.579 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.582 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.491 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.54 ' NE2' ' HE1' ' A' ' 27' ' ' HIS . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.582 ' HA ' HG21 ' A' ' 5' ' ' THR . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.487 ' CD1' HD13 ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.691 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.603 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' CD2' ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.826 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 20' ' ' LYS . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.616 HG12 HD21 ' A' ' 47' ' ' LEU . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.826 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.4 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.814 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 6.6 m80 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.422 ' HA ' HD11 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.814 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.465 HD21 HD13 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.671 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.634 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.743 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.671 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.13 -11.56 62.54 Favored Glycine 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -81.98 0.14 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.783 -0.245 . . . . 0.0 110.83 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.489 ' HD2' ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -133.52 177.15 7.92 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 177.158 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.76 HD12 ' HG2' ' A' ' 95' ' ' ARG . 13.3 mt -93.05 -37.68 12.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 -175.703 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.51 -42.3 1.21 Allowed Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.541 ' HG3' HG13 ' A' ' 97' ' ' ILE . 1.3 mp0 57.22 27.91 14.32 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 122.992 0.517 . . . . 0.0 112.321 173.73 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.33 99.16 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.436 0.636 . . . . 0.0 110.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 172.9 26.66 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.865 -177.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.85 3.34 18.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.989 0.424 . . . . 0.0 110.918 -179.186 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.477 ' CD ' ' HG3' ' A' ' 92' ' ' GLU . 4.3 mtp85 -129.68 170.51 13.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.281 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.701 ' HG ' ' HG3' ' A' ' 95' ' ' ARG . 6.0 tt -140.69 121.61 14.53 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -126.17 144.78 50.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.068 -175.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.694 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.655 ' HB2' HD23 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.441 HD23 ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.694 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.655 HD23 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.414 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.838 ' HB3' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.509 ' HD3' ' OE1' ' A' ' 94' ' ' GLU . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.743 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.604 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -79.31 -39.79 31.98 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.585 HD13 ' HA2' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -69.77 -57.89 4.56 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.919 177.987 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.416 ' HB3' HD12 ' A' ' 63' ' ' LEU . 5.4 tpp180 -162.93 -99.29 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.038 175.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 1.099 ' H ' HD12 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -106.34 -50.42 3.15 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 176.068 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.6 ' N ' HD22 ' A' ' 63' ' ' LEU . . . -126.59 7.14 7.46 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.689 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.585 ' HA2' HD13 ' A' ' 61' ' ' LEU . . . 25.91 43.71 0.02 OUTLIER Glycine 0 N--CA 1.468 0.812 0 N-CA-C 116.178 1.231 . . . . 0.0 116.178 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -45.79 51.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.017 0.437 . . . . 0.0 110.895 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.419 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -139.36 -19.88 0.44 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.518 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.63 -69.43 3.36 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.379 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.36 -58.48 0.69 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.013 0.435 . . . . 0.0 110.31 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 44.7 mtm -76.45 -70.58 0.44 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.711 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.419 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 156.27 -60.15 0.36 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.981 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.77 65.27 0.77 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.031 0.443 . . . . 0.0 110.054 178.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.425 ' HA3' ' HE1' ' A' ' 89' ' ' PHE . . . -58.74 109.5 2.06 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.571 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -164.03 -111.83 0.26 Allowed Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.437 ' C ' HG23 ' A' ' 76' ' ' VAL . 28.5 t70 -83.66 93.58 7.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.049 0.452 . . . . 0.0 109.925 173.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.52 ' HB ' HG12 ' A' ' 79' ' ' VAL . 1.9 t -137.49 162.88 32.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.85 -177.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.3 mtm -54.95 109.54 0.53 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.2 t 50.55 76.26 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.839 0.712 . . . . 0.0 111.808 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.52 HG12 ' HB ' ' A' ' 76' ' ' VAL . 0.0 OUTLIER -101.63 -20.82 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.488 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.45 2.03 90.55 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -173.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.716 ' HG3' HD21 ' A' ' 84' ' ' LEU . 5.5 mp0 46.15 69.77 2.43 Favored Pre-proline 0 C--O 1.232 0.168 0 C-N-CA 123.759 0.824 . . . . 0.0 111.763 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.412 ' HB2' ' H ' ' A' ' 83' ' ' THR . 59.6 Cg_endo -88.46 -128.39 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.243 2.628 . . . . 0.0 111.206 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.473 ' HB ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -78.12 77.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.501 176.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.716 HD21 ' HG3' ' A' ' 81' ' ' GLU . 0.2 OUTLIER -74.23 98.64 3.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 110.53 -175.941 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.655 ' HE1' ' HA ' ' A' ' 92' ' ' GLU . 0.9 OUTLIER -136.94 24.41 3.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.356 -175.419 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 65.79 55.94 17.26 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.804 -0.712 . . . . 0.0 113.095 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.03 -58.3 4.77 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.365 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.466 ' CD ' HH22 ' A' ' 58' ' ' ARG . 1.1 mt-10 -87.16 67.67 9.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.613 0.244 . . . . 0.0 110.945 -177.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.473 ' HB3' ' HB ' ' A' ' 83' ' ' THR . 0.0 OUTLIER -75.99 139.49 41.54 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 110.938 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.689 ' HA3' ' HD2' ' A' ' 57' ' ' ARG . . . 174.97 -101.25 0.16 Allowed Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.433 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.647 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 11.1 p-10 -105.83 -102.92 0.33 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.914 -0.643 . . . . 0.0 110.677 -178.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.655 ' HA ' ' HE1' ' A' ' 85' ' ' MET . 0.5 OUTLIER -142.65 -52.66 0.39 Allowed 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 122.347 -0.221 . . . . 0.0 111.098 178.437 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.472 ' C ' ' HG2' ' A' ' 94' ' ' GLU . 0.2 OUTLIER -140.81 26.16 2.1 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.624 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.838 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER 41.33 -108.34 0.09 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.803 1.241 . . . . 0.0 114.086 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.76 ' HG2' HD12 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -132.29 125.61 31.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -167.971 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -122.12 159.89 26.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 171.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.541 HG13 ' HG3' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.603 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.691 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t -102.17 -123.59 0.18 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.9 70.67 1.29 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -162.63 101.56 1.04 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.252 -175.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -96.37 -81.99 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.082 0.467 . . . . 0.0 110.139 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 64.07 37.0 9.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.189 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -95.38 -171.74 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.056 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -91.2 22.03 4.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.8 0.333 . . . . 0.0 111.139 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -79.49 -87.13 0.54 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.34 176.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -103.59 -69.53 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -166.01 -108.96 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.136 172.306 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 15.5 t0 -120.31 97.15 5.45 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.831 -0.604 . . . . 0.0 110.236 -177.721 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.463 ' HA2' HG22 ' A' ' 103' ' ' THR . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.88 122.01 19.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.916 0.388 . . . . 0.0 110.611 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.24 166.58 22.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.508 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.444 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.611 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.611 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.477 ' HA ' HG23 ' A' ' 5' ' ' THR . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.643 ' HB2' ' O ' ' A' ' 110' ' ' GLY . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.522 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.768 HD22 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.602 ' HB1' HD12 ' A' ' 96' ' ' LEU . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.852 HG12 HD12 ' A' ' 47' ' ' LEU . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.574 ' CZ2' HD13 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.973 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.973 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.932 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.852 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.503 ' CB ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.41 ' HB2' HD13 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.852 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.63 25.05 8.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.463 ' HB2' ' H ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -92.06 -104.95 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 117.155 0.477 . . . . 0.0 110.75 178.28 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.932 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.0 OUTLIER -166.5 159.49 14.48 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.109 0.413 . . . . 0.0 111.471 -178.717 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.783 HD12 ' HG3' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -136.37 137.65 40.78 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.567 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 168.36 62.9 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 119.581 -1.295 . . . . 0.0 114.526 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.578 ' HB2' ' O ' ' A' ' 81' ' ' GLU . 5.3 mt-10 -118.84 -82.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.14 0.47 . . . . 0.0 110.367 172.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.611 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -137.96 132.66 43.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 120.446 0.165 . . . . 0.0 110.697 177.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.547 ' CA ' ' HB3' ' A' ' 77' ' ' MET . . . -156.93 -169.93 21.37 Favored Glycine 0 N--CA 1.461 0.329 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.702 ' HD3' ' OD1' ' A' ' 93' ' ' ASP . 0.0 OUTLIER -137.56 -69.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.03 0.915 . . . . 0.0 111.19 177.352 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.469 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 2.6 mtm180 -117.27 -173.64 2.45 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.939 ' HG ' ' HA ' ' A' ' 95' ' ' ARG . 0.2 OUTLIER -117.17 149.74 39.87 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -174.521 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.615 ' HE2' ' HB2' ' A' ' 91' ' ' ASP . 6.2 m-85 -116.7 146.12 42.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.935 175.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.987 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.987 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.579 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.579 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.464 ' HA ' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.703 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.464 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -73.55 -30.31 62.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.78 HD22 ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -87.23 -61.74 1.66 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.571 0.701 . . . . 0.0 110.729 177.145 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.488 ' O ' ' HA ' ' A' ' 59' ' ' ASP . 1.0 OUTLIER -145.09 -99.98 0.1 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 178.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.1 OUTLIER -125.87 -36.07 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.241 0.543 . . . . 0.0 109.67 166.576 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.703 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -141.6 43.74 1.06 Allowed Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.224 -176.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.78 ' HA3' HD22 ' A' ' 61' ' ' LEU . . . -65.05 40.63 0.11 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 -172.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.605 ' OG ' ' HD2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.1 47.09 0.89 Allowed 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 123.32 0.648 . . . . 0.0 110.642 179.245 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.706 ' HA2' ' O ' ' A' ' 87' ' ' GLY . . . 29.37 -98.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.44 0 O-C-N 124.106 0.879 . . . . 0.0 114.911 -169.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.769 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . -171.44 -122.53 0.65 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.647 -1.263 . . . . 0.0 112.878 177.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.424 ' HB3' ' H ' ' A' ' 70' ' ' MET . 4.5 t-80 -136.93 -86.98 0.31 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.88 0.372 . . . . 0.0 111.455 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.424 ' H ' ' HB3' ' A' ' 69' ' ' HIS . 0.7 OUTLIER -90.26 -46.86 8.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.804 -176.318 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.96 35.84 4.78 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.304 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.769 ' HB3' ' HA3' ' A' ' 68' ' ' GLY . 4.7 t -173.23 158.61 3.65 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.04 -169.54 31.17 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.91 179.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -121.95 -53.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.615 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -80.51 158.91 25.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.583 0.23 . . . . 0.0 110.955 -179.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -100.36 93.89 3.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 109.825 176.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.594 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . 40.3 mtm -75.93 160.77 29.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.54 -174.852 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -149.99 -36.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.566 HG13 ' HA ' ' A' ' 96' ' ' LEU . 12.2 t -69.34 -45.69 78.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -166.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.506 ' H ' ' N ' ' A' ' 44' ' ' GLY . . . 144.54 93.35 0.16 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 119.301 -1.428 . . . . 0.0 114.832 177.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.611 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 1.8 pt-20 -157.95 163.54 24.27 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.522 ' C ' ' HG ' ' A' ' 66' ' ' SER . 50.7 Cg_exo -60.42 -171.76 0.07 OUTLIER 'Trans proline' 0 N--CA 1.48 0.706 0 C-N-CA 122.664 2.243 . . . . 0.0 112.979 -174.046 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.512 ' OG1' ' HA2' ' A' ' 68' ' ' GLY . 0.5 OUTLIER -177.06 160.16 1.74 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.174 -0.329 . . . . 0.0 111.339 179.209 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -105.01 -179.89 4.08 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.014 0.435 . . . . 0.0 110.718 178.041 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 19.6 ttt -91.66 -38.11 12.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.982 174.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -152.99 120.71 1.08 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.335 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.706 ' O ' ' HA2' ' A' ' 67' ' ' GLY . . . 149.19 106.75 0.4 Allowed Glycine 0 C--O 1.222 -0.635 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.043 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.75 143.08 27.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.131 0.465 . . . . 0.0 111.107 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.449 ' HD2' ' H ' ' A' ' 67' ' ' GLY . 90.3 m-85 -132.32 -167.55 1.91 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.32 -178.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.79 15.14 12.64 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.747 -173.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.615 ' HB2' ' HE2' ' A' ' 48' ' ' TYR . 1.1 p30 -116.35 -87.12 0.61 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.947 0.374 . . . . 0.0 111.148 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 63.83 10.1 4.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.424 0.631 . . . . 0.0 110.644 -177.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.702 ' OD1' ' HD3' ' A' ' 45' ' ' ARG . 14.5 t0 -120.69 35.45 4.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.104 -171.023 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE2' ' HG2' ' A' ' 58' ' ' ARG . 17.1 tt0 -79.21 -47.56 15.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.939 ' HA ' ' HG ' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.47 125.22 23.92 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.805 -1.158 . . . . 0.0 114.074 -168.679 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.602 HD12 ' HB1' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -124.41 156.81 36.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.002 172.857 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.517 ' H ' HG13 ' A' ' 79' ' ' VAL . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.768 ' HD2' HD22 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.588 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.463 HG22 ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -140.42 -103.87 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . 0.437 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -161.79 94.29 0.94 Allowed 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 110' ' ' GLY . 12.4 t80 -35.6 -55.16 0.69 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -168.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.655 ' HB2' ' HB2' ' A' ' 113' ' ' ASP . 0.3 OUTLIER -37.26 -48.79 0.9 Allowed 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.727 0.642 . . . . 0.0 112.149 -175.995 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -124.74 26.39 7.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.63 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -169.75 -137.74 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.887 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . 0.419 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 29.6 t-20 -131.63 45.38 2.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.177 0.513 . . . . 0.0 111.701 -176.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . 0.643 ' O ' ' HB2' ' A' ' 16' ' ' ARG . . . -103.35 -147.48 18.41 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.679 176.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.591 HG21 ' HD2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -94.02 -60.01 2.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 117.292 0.546 . . . . 0.0 110.28 176.618 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -132.69 -176.51 4.13 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.217 -0.901 . . . . 0.0 108.824 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.655 ' HB2' ' HB2' ' A' ' 106' ' ' ASP . 15.0 t70 -87.68 142.27 27.96 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.724 0.297 . . . . 0.0 110.491 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.969 -0.539 . . . . 0.0 109.723 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.44 140.87 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.721 0.295 . . . . 0.0 110.649 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mt -100.17 -169.91 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.113 178.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.723 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.478 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.459 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.632 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.478 ' HA ' HG22 ' A' ' 5' ' ' THR . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.433 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.565 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.704 HD23 HD13 ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.856 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.662 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.662 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.856 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.487 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.703 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.492 ' CB ' ' HG ' ' A' ' 38' ' ' CYS . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.851 ' HB3' HD11 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.643 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.44 22.46 75.55 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.492 ' HG ' ' CB ' ' A' ' 33' ' ' CYS . 0.5 OUTLIER -98.03 -109.73 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.526 0.663 . . . . 0.0 110.367 178.567 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.2 168.17 19.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.703 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 72.3 mt -90.53 111.7 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.793 0.33 . . . . 0.0 110.391 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -144.9 -43.63 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.862 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -87.69 55.56 3.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.016 0.436 . . . . 0.0 110.02 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG12 ' NH2' ' A' ' 58' ' ' ARG . 0.9 OUTLIER -129.74 -175.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.029 -176.831 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.47 -167.44 18.46 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.428 ' HE ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -71.23 -9.52 58.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 117.372 0.586 . . . . 0.0 110.353 177.198 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.61 ' HB3' HD22 ' A' ' 96' ' ' LEU . 2.0 mtp180 -103.13 -169.67 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.755 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.641 HD11 HD13 ' A' ' 40' ' ' LEU . 0.4 OUTLIER -160.54 176.4 11.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.767 177.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.595 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 -142.1 144.59 33.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.352 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.504 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.456 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.456 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.504 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.851 HD11 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.595 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.457 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.705 ' HA ' ' HD2' ' A' ' 62' ' ' ARG . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.448 ' HB2' HD12 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -76.7 -36.74 57.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.633 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -78.52 -9.12 59.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.287 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.853 HH21 ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -65.55 -29.13 69.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 178.322 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -36.76 2.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.543 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.91 -7.03 86.2 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.437 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.633 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -121.15 -109.04 2.12 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.514 177.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.36 -72.05 0.37 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.879 0.371 . . . . 0.0 110.48 176.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.81 -72.55 0.32 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.18 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.545 ' HA2' HD23 ' A' ' 84' ' ' LEU . . . 62.1 35.31 91.29 Favored Glycine 0 C--O 1.226 -0.346 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.01 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.853 ' HA ' HH21 ' A' ' 62' ' ' ARG . 1.8 m-70 -100.59 -37.88 8.59 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.97 0.415 . . . . 0.0 110.553 -177.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.42 -25.58 61.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.712 -178.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -95.08 101.62 2.74 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.519 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 m -155.72 61.19 0.6 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.34 0.591 . . . . 0.0 110.079 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.417 ' H ' ' N ' ' A' ' 87' ' ' GLY . . . 73.83 173.1 27.16 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.688 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 68.68 -124.6 18.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.476 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -122.02 142.65 50.12 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.1 p -109.58 147.57 13.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.657 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.533 ' HB3' ' HE3' ' A' ' 77' ' ' MET . 1.5 mtm -65.51 106.98 1.55 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.05 177.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -63.23 104.8 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.631 -174.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.491 ' H ' ' HG3' ' A' ' 82' ' ' PRO . 11.8 p -91.22 38.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-O 122.223 1.011 . . . . 0.0 109.933 178.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.89 -60.13 3.52 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.506 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -154.52 83.18 4.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HG3' ' H ' ' A' ' 79' ' ' VAL . 4.6 Cg_exo -78.93 148.42 22.06 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.526 2.151 . . . . 0.0 112.762 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -9.21 58.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.624 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.707 ' HB3' ' CD1' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -118.12 99.7 7.05 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.27 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 8.1 ttt -91.78 -42.05 10.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -125.73 -160.41 10.64 Favored Glycine 0 N--CA 1.441 -1.003 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.417 ' N ' ' H ' ' A' ' 73' ' ' GLY . . . -70.79 -39.32 65.75 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.31 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -82.86 55.43 3.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.693 -0.253 . . . . 0.0 111.184 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.707 ' CD1' ' HB3' ' A' ' 84' ' ' LEU . 2.1 m-85 -26.07 -73.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.397 1.079 . . . . 0.0 112.714 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.74 87.16 0.42 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.545 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.1 -99.65 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.522 -0.339 . . . . 0.0 110.396 -176.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 67.09 -42.46 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.058 0.943 . . . . 0.0 113.499 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.27 35.24 3.12 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 120.956 0.408 . . . . 0.0 111.252 -173.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.68 138.4 45.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.126 0.489 . . . . 0.0 111.216 -177.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.481 ' H ' ' HE1' ' A' ' 49' ' ' TYR . 2.4 ttt85 -97.25 -2.02 43.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.797 176.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.61 HD22 ' HB3' ' A' ' 46' ' ' ARG . 11.9 mt 59.43 -159.33 0.3 Allowed 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.866 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.704 HD13 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.562 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.565 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.461 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m -43.74 -55.88 4.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -4.73 4.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.407 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -126.01 -135.65 0.26 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 121.965 -0.459 . . . . 0.0 110.142 178.552 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.461 ' O ' ' HB3' ' A' ' 101' ' ' GLU . 11.0 t70 -178.05 -77.37 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.728 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 51.71 33.53 11.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.034 178.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.28 -59.73 0.77 Allowed 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.459 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -137.45 -16.03 1.39 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.811 0.339 . . . . 0.0 111.555 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.45 -166.85 39.25 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.658 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.1 mp -93.12 -13.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.356 0.598 . . . . 0.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.77 65.95 4.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.197 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -108.99 143.49 38.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.307 -176.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.256 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.55 120.13 16.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.734 0.302 . . . . 0.0 110.366 178.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -72.79 170.33 14.86 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.442 ' HB2' ' HB ' ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' HA ' ' A' ' 12' ' ' ASN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.654 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.598 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.598 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.54 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.621 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.493 HD21 ' HD2' ' A' ' 99' ' ' ARG . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.963 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.834 HD12 ' HB3' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.963 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.567 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.784 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.784 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.529 HD11 HD11 ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.777 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.949 ' HB2' ' H ' ' A' ' 38' ' ' CYS . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' NE ' ' A' ' 95' ' ' ARG . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.568 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.452 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 68.21 45.92 67.83 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.949 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.38 -89.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 117.134 0.467 . . . . 0.0 110.823 178.083 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.41 ' H ' ' HB2' ' A' ' 38' ' ' CYS . 2.3 tpt180 -158.8 169.06 25.21 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.549 0.214 . . . . 0.0 110.92 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.777 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 79.9 mt -109.1 -85.73 0.53 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.824 0.345 . . . . 0.0 110.712 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 131.22 -34.12 2.67 Favored Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.004 -0.839 . . . . 0.0 111.004 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER 50.26 51.71 16.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.43 0.692 . . . . 0.0 111.873 173.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 m -140.85 9.54 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.548 ' HA3' ' HA ' ' A' ' 91' ' ' ASP . . . -78.51 7.34 48.36 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.293 -0.955 . . . . 0.0 111.968 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.49 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 0.3 OUTLIER 166.96 -85.95 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 176.743 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.506 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -134.38 3.6 3.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.968 -1.469 . . . . 0.0 107.962 158.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.81 ' HB3' ' HB2' ' A' ' 96' ' ' LEU . 0.2 OUTLIER 155.92 -171.62 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-N 113.917 -1.492 . . . . 0.0 108.876 174.332 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.845 ' HD2' ' HG3' ' A' ' 94' ' ' GLU . 1.4 t80 -159.05 147.21 17.93 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.679 ' HB3' ' H ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.617 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.617 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.834 ' HB3' HD12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.854 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.576 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.716 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.545 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.456 ' CE2' HD13 ' A' ' 61' ' ' LEU . 0.1 OUTLIER -78.08 -44.17 27.01 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.513 HD12 ' HA ' ' A' ' 61' ' ' LEU . 0.0 OUTLIER -66.23 -56.17 12.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.172 176.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.705 ' HB2' ' HB3' ' A' ' 66' ' ' SER . 10.9 tpp180 -163.71 -80.47 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.702 -1.136 . . . . 0.0 108.04 169.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.424 ' H ' ' HB3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -127.62 -29.15 2.67 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.043 168.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.716 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -135.07 -66.04 0.07 OUTLIER Glycine 0 N--CA 1.435 -1.424 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.757 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -145.58 21.55 1.85 Allowed Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.018 -1.087 . . . . 0.0 114.425 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.705 ' HB3' ' HB2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER 26.62 43.95 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -175.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -108.78 42.28 1.99 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.306 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.56 -24.29 61.69 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.443 -0.408 . . . . 0.0 112.939 -177.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.64 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.612 0.72 . . . . 0.0 111.258 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.513 ' HE2' ' HB3' ' A' ' 70' ' ' MET . 12.7 mtp -68.14 -38.45 82.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.007 -177.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 126.2 -45.79 1.13 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.12 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.85 123.68 29.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.528 0.204 . . . . 0.0 110.513 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.618 ' HA2' ' HA2' ' A' ' 87' ' ' GLY . . . 93.49 -167.38 28.64 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.355 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 145.95 -8.59 1.51 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.105 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -136.81 139.36 41.71 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 117.526 0.663 . . . . 0.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.0 t -77.82 124.88 36.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.101 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.496 ' HG2' ' O ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -70.26 113.63 7.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.137 178.452 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.3 m -117.43 -0.37 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.626 -176.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 1.6 t -110.87 -27.8 2.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.277 0.56 . . . . 0.0 110.42 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.74 24.17 1.57 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.712 -178.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.9 mp0 -75.25 135.8 72.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 5.3 Cg_exo -80.39 147.97 18.33 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.242 1.961 . . . . 0.0 112.143 -177.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' THR . . . . . 0.457 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 0.2 OUTLIER -75.21 98.03 3.65 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.161 178.694 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mt -88.59 -179.16 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.914 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -38.49 64.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.92 0.39 . . . . 0.0 110.519 -179.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.14 70.67 0.55 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.893 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.618 ' HA2' ' HA2' ' A' ' 73' ' ' GLY . . . 96.01 158.25 32.02 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.348 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.496 ' O ' ' HG2' ' A' ' 77' ' ' MET . 3.0 mp0 -83.09 31.41 0.44 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.901 0.381 . . . . 0.0 111.94 -176.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.492 ' CE2' ' HA3' ' A' ' 87' ' ' GLY . 0.0 OUTLIER -122.87 152.53 40.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.299 -177.72 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -138.11 80.49 0.29 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.966 -0.853 . . . . 0.0 110.966 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.548 ' HA ' ' HA3' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -147.75 -85.87 0.1 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.16 -0.52 . . . . 0.0 110.069 -171.9 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.664 ' HA ' ' HG2' ' A' ' 58' ' ' ARG . 1.9 mp0 72.67 -16.03 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.708 0.803 . . . . 0.0 112.502 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.544 ' O ' HD23 ' A' ' 47' ' ' LEU . 1.9 p30 -115.08 34.27 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -174.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.854 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 0.1 OUTLIER -64.19 101.64 0.43 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -173.355 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.641 ' HB3' HD13 ' A' ' 40' ' ' LEU . 0.1 OUTLIER 179.51 45.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.191 1.396 . . . . 0.0 108.639 176.056 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.81 ' HB2' ' HB3' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -70.29 147.21 49.94 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -165.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.536 HD12 HD13 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.621 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.405 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m -56.88 -65.82 0.55 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -84.37 54.19 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.213 0.53 . . . . 0.0 111.594 -176.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.54 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 57.3 t80 -126.64 -33.83 2.49 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.285 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -44.83 -33.16 1.82 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.478 -177.59 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 106' ' ' ASP . . . 100.25 51.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 O-C-N 125.24 1.587 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -91.44 -25.58 19.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.194 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -97.1 -20.25 18.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.788 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -174.85 -146.4 5.72 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.122 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -92.27 -39.53 11.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 0.0 109.996 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -108.61 87.25 2.45 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.516 ' HB2' ' HA ' ' A' ' 107' ' ' ALA . 6.2 t0 -53.33 138.73 31.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.396 -1.275 . . . . 0.0 112.788 -169.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.878 -1.058 . . . . 0.0 109.044 178.304 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -165.54 0.84 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.845 0.355 . . . . 0.0 111.108 -179.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt -99.87 -49.37 4.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.407 HG23 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.707 ' CA ' ' HG2' ' A' ' 46' ' ' ARG . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.618 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.618 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.509 HG22 ' OD1' ' A' ' 102' ' ' ASN . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.494 ' HB2' ' HD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.644 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.585 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.926 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.526 ' HB1' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.573 ' HA ' HD11 ' A' ' 96' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.926 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.561 ' CZ2' HD13 ' A' ' 47' ' ' LEU . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 1.019 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.421 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 1.019 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.565 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.974 ' H ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.585 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.464 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.915 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.25 10.44 78.53 Favored Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.9 m -65.43 -59.42 4.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.887 0.344 . . . . 0.0 110.744 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -68.69 0.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.29 177.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.974 HD12 ' H ' ' A' ' 32' ' ' SER . 9.6 mp -48.69 -56.35 8.79 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -174.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.62 89.71 1.07 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -169.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.59 0.56 33.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -168.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.416 ' H ' HG23 ' A' ' 43' ' ' VAL . 2.9 m -96.91 8.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -176.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.46 9.8 0.05 OUTLIER Glycine 0 CA--C 1.52 0.402 0 C-N-CA 118.926 -1.607 . . . . 0.0 115.311 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -110.63 -97.34 0.41 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 118.695 1.248 . . . . 0.0 112.228 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.707 ' HG2' ' CA ' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -100.93 160.05 14.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.511 -171.877 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.979 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -150.13 143.98 25.41 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.565 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -125.83 94.41 4.11 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 166.812 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.82 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.54 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.54 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.979 ' HE2' ' HB3' ' A' ' 47' ' ' LEU . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.915 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.64 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.618 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.618 ' CD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -60.32 -34.56 73.99 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.744 ' HG ' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -76.12 -9.54 58.7 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.386 -177.595 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.479 ' HA ' ' NE ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -110.15 -52.58 2.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.242 176.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.595 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.0 OUTLIER -73.9 -39.95 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.747 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.595 ' N ' ' HG ' ' A' ' 63' ' ' LEU . . . -83.22 -19.55 62.4 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 175.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -80.38 41.55 2.49 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.87 5.36 1.14 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -172.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -78.55 12.39 21.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.944 174.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.59 -108.68 2.56 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 142.14 51.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.258 0.551 . . . . 0.0 109.946 172.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.538 ' HG3' ' N ' ' A' ' 71' ' ' GLY . 0.0 OUTLIER -112.1 -32.14 6.66 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.628 177.646 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.538 ' N ' ' HG3' ' A' ' 70' ' ' MET . . . 130.31 37.05 0.35 Allowed Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 113.464 -1.698 . . . . 0.0 110.773 -174.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.628 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -112.93 -158.06 0.64 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.604 -175.665 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.47 ' HA2' HG22 ' A' ' 76' ' ' VAL . . . -85.17 -92.61 0.8 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.575 179.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.02 -103.66 2.15 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -110.92 95.99 5.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.47 HG22 ' HA2' ' A' ' 73' ' ' GLY . 8.6 t -130.58 136.11 59.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.755 -176.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.445 ' N ' HG11 ' A' ' 76' ' ' VAL . 17.7 mtm -68.94 99.17 1.02 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.932 0.396 . . . . 0.0 110.574 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.8 m -112.94 -177.92 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.274 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.5 p -80.34 -13.14 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 169.46 -69.48 0.15 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.359 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.432 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 11.0 mm-40 -97.26 146.11 30.78 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.8 Cg_exo -74.82 148.55 36.3 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.433 2.089 . . . . 0.0 111.413 178.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.31 166.37 11.35 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.542 -177.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.37 98.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.92 34.92 4.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.091 -173.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.38 -37.48 3.66 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.7 -164.39 31.99 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.744 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 33.4 mt-10 38.36 80.09 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.627 0.771 . . . . 0.0 113.053 174.637 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.0 -147.32 0.36 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.611 177.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -92.07 -85.68 1.5 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.535 ' C ' ' H ' ' A' ' 93' ' ' ASP . 0.2 OUTLIER -124.57 -118.02 0.28 Allowed 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.775 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 62.88 -6.35 0.17 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.432 0.693 . . . . 0.0 112.291 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.575 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.9 t70 -92.94 -11.08 34.23 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.582 -175.027 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.401 ' HG3' HG13 ' A' ' 97' ' ' ILE . 10.5 pm0 -52.13 142.13 17.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.077 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 51' ' ' LEU . 2.5 ttp85 -55.17 -77.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.039 -173.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.573 HD11 ' HA ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.52 85.73 2.37 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.457 -175.49 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.526 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.489 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.644 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.509 ' OD1' HG22 ' A' ' 13' ' ' ILE . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.09 -87.66 0.33 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -136.0 44.77 2.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.575 -177.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.494 ' HD2' ' HB2' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -76.88 65.18 2.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.458 0.647 . . . . 0.0 109.893 176.231 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -61.12 1.88 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.993 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.588 ' HB2' ' HA ' ' A' ' 114' ' ' GLU . . . -131.13 -51.83 1.03 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.393 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . 0.409 ' CB ' ' HB3' ' A' ' 113' ' ' ASP . . . -103.66 148.0 26.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.269 175.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -88.25 45.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.281 -174.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -103.61 -123.76 5.32 Favored Glycine 0 C--N 1.321 -0.284 0 C-N-CA 120.453 -0.879 . . . . 0.0 111.057 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 2.1 mt -88.82 -100.27 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -107.79 77.76 1.15 Allowed 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 169.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . 0.409 ' HB3' ' CB ' ' A' ' 108' ' ' ALA . 12.1 t0 -115.45 150.72 36.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.863 -177.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.588 ' HA ' ' HB2' ' A' ' 107' ' ' ALA . 1.0 OUTLIER . . . . . 0 C--N 1.316 -0.857 0 CA-C-O 118.885 -0.578 . . . . 0.0 109.656 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.527 ' HA2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.745 -0.542 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -35.32 79.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.023 0.439 . . . . 0.0 111.06 -177.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.542 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp -121.14 -105.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.967 178.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.415 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.585 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.585 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.542 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.938 ' HB3' ' HA ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.601 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.89 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.536 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.496 ' HB3' ' HB3' ' A' ' 95' ' ' ARG . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.784 HD13 ' HA ' ' A' ' 48' ' ' TYR . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.512 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.773 ' HA ' HG12 ' A' ' 43' ' ' VAL . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.731 ' HA ' ' O ' ' A' ' 46' ' ' ARG . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.788 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.691 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.585 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.691 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 102.93 6.89 45.31 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.9 m -89.48 -113.74 0.07 Allowed 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.788 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 0.0 OUTLIER -158.13 152.73 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.664 0.269 . . . . 0.0 111.288 178.851 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.7 HD22 HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -113.66 32.81 5.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 178.549 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 138.75 -66.32 0.53 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.244 -0.743 . . . . 0.0 111.244 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 3.1 mm-40 -86.22 -119.45 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.851 0.358 . . . . 0.0 110.038 175.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.773 HG12 ' HA ' ' A' ' 29' ' ' ASP . 1.2 p -158.77 147.13 8.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 178.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.476 ' N ' ' HB2' ' A' ' 32' ' ' SER . . . 160.2 -168.61 35.86 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 119.5 -1.334 . . . . 0.0 113.877 -175.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.801 ' HG2' ' HG2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -132.09 -23.85 2.16 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -175.0 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.801 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -124.28 152.48 42.98 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.08 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.713 HD22 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -154.28 -161.71 1.28 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.837 0.29 . . . . 0.0 110.71 -176.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.784 ' HA ' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -67.94 144.77 55.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.816 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.617 ' HD3' HD12 ' A' ' 51' ' ' LEU . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.873 HD21 ' HB ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.485 ' N ' HD23 ' A' ' 51' ' ' LEU . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.816 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.507 HD13 HD12 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.713 ' HA ' HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.533 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.552 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.467 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.715 ' OH ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -65.88 -28.6 69.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.594 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.5 OUTLIER -79.01 -0.54 31.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.285 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.552 ' HD2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -105.41 -48.21 3.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.847 0.356 . . . . 0.0 110.822 177.576 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.01 -35.71 25.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.463 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.96 -20.75 30.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.594 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -88.4 41.34 3.06 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 174.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -11.25 35.22 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.63 0.772 . . . . 0.0 112.996 -173.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.444 ' HA3' ' HB2' ' A' ' 72' ' ' SER . . . -76.07 -24.72 68.27 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.657 -177.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.74 -16.97 43.08 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -88.94 -132.94 0.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.483 ' HB3' ' HG2' ' A' ' 85' ' ' MET . 0.0 OUTLIER -65.91 -30.29 70.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 176.108 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -179.14 -63.92 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.892 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.444 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 41.39 57.78 2.84 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.663 ' O ' ' HA3' ' A' ' 87' ' ' GLY . . . 171.26 -162.53 35.25 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.426 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.92 97.03 0.54 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.445 178.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -95.73 101.8 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.209 -0.664 . . . . 0.0 109.209 175.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -133.66 164.48 34.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.467 -174.616 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.5 mtt -63.35 149.05 46.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.89 0.376 . . . . 0.0 110.964 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.18 103.13 6.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.08 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.873 ' HB ' HD21 ' A' ' 51' ' ' LEU . 3.5 t -110.92 -37.95 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.583 -179.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.74 44.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.583 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.541 ' HG2' ' HB3' ' A' ' 88' ' ' GLU . 4.7 mp0 -64.25 111.68 6.03 Favored Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 123.033 0.533 . . . . 0.0 111.413 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -79.16 -80.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.238 2.625 . . . . 0.0 112.188 -179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 101.3 11.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.887 -176.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.484 HD22 ' HB3' ' A' ' 81' ' ' GLU . 4.8 mt -91.88 115.09 27.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.248 178.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.483 ' HG2' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -106.17 36.13 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.737 -174.953 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 112.33 -30.78 7.36 Favored Glycine 0 N--CA 1.453 -0.219 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -174.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . 0.663 ' HA3' ' O ' ' A' ' 73' ' ' GLY . . . -129.54 -161.96 10.7 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 175.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.541 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 22.1 mt-10 -102.42 83.65 2.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.632 0.73 . . . . 0.0 112.015 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.715 ' HB3' ' OH ' ' A' ' 60' ' ' TYR . 17.0 m-85 -102.73 -173.27 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.896 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -106.26 -100.2 2.64 Favored Glycine 0 N--CA 1.44 -1.045 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.014 179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.45 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 3.3 p-10 -107.78 -120.85 0.25 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.078 0.466 . . . . 0.0 111.164 -174.234 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 91' ' ' ASP . 3.3 mm-40 -153.08 -50.47 0.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.191 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.446 ' HB2' HD13 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -142.66 -31.04 0.52 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.529 177.061 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.414 ' HB3' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER 59.87 -102.7 0.14 Allowed 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.352 0.407 . . . . 0.0 110.185 -178.186 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.496 ' HB3' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.0 -14.31 8.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.583 176.543 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.446 HD13 ' HB2' ' A' ' 93' ' ' ASP . 30.4 mt 49.39 -106.98 0.22 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 110.853 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.687 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.89 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.601 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.41 HD22 HD21 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m -161.52 -61.54 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.73 -68.21 0.38 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.038 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.938 ' HA ' ' HB3' ' A' ' 16' ' ' ARG . 1.8 m-85 -143.8 -128.83 0.08 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' H ' ' HB3' ' A' ' 105' ' ' PHE . 42.3 t0 -115.86 -68.27 0.93 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 167.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -163.53 22.33 0.08 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.904 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 69.57 -73.16 0.09 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.349 0.659 . . . . 0.0 110.062 -174.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -94.08 45.07 1.13 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.598 171.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.38 -143.17 5.79 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.528 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 2.6 mt -127.78 -31.43 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.13 0.49 . . . . 0.0 110.427 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.45 11.52 32.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.665 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.07 171.09 15.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.068 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.499 -0.762 . . . . 0.0 109.913 178.042 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 112.016 -0.434 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 m -91.97 143.45 26.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.94 0.4 . . . . 0.0 111.07 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.655 HD13 HD22 ' A' ' 102' ' ' ASN . 0.8 OUTLIER -125.11 -72.98 0.65 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.619 178.473 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.542 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.543 HG21 ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.677 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.517 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.543 ' HA ' HG21 ' A' ' 5' ' ' THR . 5.4 t30 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.637 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.588 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.846 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.541 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.578 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.846 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.578 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.563 HD12 HD11 ' A' ' 97' ' ' ILE . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.716 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.5 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.569 HD21 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.453 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 84.5 -2.57 87.84 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -83.75 0.17 Allowed 'General case' 0 C--N 1.322 -0.597 0 O-C-N 122.775 -0.25 . . . . 0.0 111.232 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.438 ' HB3' ' H ' ' A' ' 40' ' ' LEU . 2.8 mtt85 -157.98 -149.07 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.438 ' H ' ' HB3' ' A' ' 39' ' ' ARG . 4.4 mt -119.5 77.55 1.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.02 17.62 37.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.221 -177.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.532 ' OE1' ' HG2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.07 -158.29 0.66 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.5 t -65.8 105.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.56 70.3 0.22 Allowed Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.234 -173.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -116.16 -39.27 3.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 172.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.575 ' HG3' ' HE1' ' A' ' 48' ' ' TYR . 7.6 ptm180 -137.1 98.32 3.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.27 173.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.561 HD22 HD13 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -86.84 110.71 20.14 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 -174.302 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.575 ' HE1' ' HG3' ' A' ' 46' ' ' ARG . 5.4 m-85 -85.87 97.62 10.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.257 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.719 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.627 ' HD3' HD12 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.471 ' HG ' ' HG3' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.5 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.719 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.716 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.763 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.546 ' HD3' ' CD1' ' A' ' 48' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.532 ' HG2' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.569 ' HB2' HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.763 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -69.38 -26.48 64.68 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.739 HD21 ' HG2' ' A' ' 88' ' ' GLU . 0.3 OUTLIER -58.27 -21.55 49.1 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HD2' ' HA ' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -61.55 -29.89 70.3 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.195 176.364 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.627 HD12 ' HD3' ' A' ' 50' ' ' LYS . 0.9 OUTLIER -128.43 10.18 6.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.896 179.435 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.461 ' CA ' ' HA3' ' A' ' 90' ' ' GLY . . . -141.73 3.64 2.08 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.389 -172.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.706 ' CA ' ' HG ' ' A' ' 61' ' ' LEU . . . -71.46 40.5 0.62 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.626 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.439 ' H ' ' C ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 26.22 39.98 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.6 1.56 . . . . 0.0 115.172 179.432 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.477 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -143.67 -121.51 1.57 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 171.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.6 ' N ' ' HA ' ' A' ' 89' ' ' PHE . . . 63.93 -97.29 0.22 Allowed Glycine 0 CA--C 1.512 -0.101 0 C-N-CA 121.461 -0.4 . . . . 0.0 113.114 172.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -46.47 90.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 -178.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -24.34 62.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.516 -179.016 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 135.35 -138.89 10.33 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.722 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.6 m -79.25 116.07 19.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 0.0 110.516 178.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.32 -24.06 9.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.467 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -178.32 90.51 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -82.51 95.28 7.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.957 0.408 . . . . 0.0 110.38 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.83 159.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.597 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.7 mtm -77.62 131.74 37.93 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 15.6 t 54.97 83.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.638 177.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.15 -16.92 7.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.953 0.406 . . . . 0.0 110.078 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . 0.43 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 119.16 111.61 2.42 Favored Glycine 0 N--CA 1.445 -0.739 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 80' ' ' GLY . 13.5 mm-40 70.61 156.55 0.16 Allowed Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 122.897 0.479 . . . . 0.0 110.786 -176.61 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -54.38 144.25 62.17 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.285 1.99 . . . . 0.0 112.287 -178.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.66 143.95 30.98 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.62 -174.765 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.554 ' H ' ' HE2' ' A' ' 89' ' ' PHE . 7.0 mt -81.41 -176.41 6.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' MET . . . . . 0.477 ' HB3' ' HE3' ' A' ' 85' ' ' MET . 41.9 ttp -54.69 -40.31 69.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.888 0.375 . . . . 0.0 110.339 -179.54 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.17 134.06 11.88 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.52 -0.847 . . . . 0.0 111.036 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.65 146.75 22.57 Favored Glycine 0 CA--C 1.506 -0.511 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.739 ' HG2' HD21 ' A' ' 61' ' ' LEU . 15.5 mt-10 61.81 110.82 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.333 0.653 . . . . 0.0 110.623 -177.486 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.6 ' HA ' ' N ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -123.61 130.59 52.89 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.511 -168.767 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . 0.461 ' HA3' ' CA ' ' A' ' 64' ' ' GLY . . . 173.56 -98.73 0.13 Allowed Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 118.664 -1.731 . . . . 0.0 114.427 171.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.56 -113.64 0.34 Allowed 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.168 -1.016 . . . . 0.0 111.396 -168.057 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.55 -56.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.362 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -136.17 -39.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.458 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 56.87 -150.96 0.43 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.474 175.039 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.477 ' HB3' ' CE1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -129.27 127.98 42.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.389 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . 0.419 ' H ' ' HG ' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -115.99 134.74 54.65 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.563 HD11 HD12 ' A' ' 31' ' ' LEU . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.588 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.637 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.655 HD22 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.22 106.43 15.0 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.84 -9.77 1.82 Allowed 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 112.499 -2.137 . . . . 0.0 110.076 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -123.39 89.06 3.03 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.587 0.708 . . . . 0.0 109.825 -177.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.33 -38.64 68.59 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.309 -177.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 65.47 57.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.381 -1.281 . . . . 0.0 110.067 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.24 67.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.121 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -117.63 40.8 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.509 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.58 -157.98 17.35 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.256 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -73.16 -21.84 19.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.983 0.421 . . . . 0.0 110.488 179.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -84.84 66.84 9.88 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 174.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -68.07 161.07 27.61 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.457 -174.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.75 177.481 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.256 -0.338 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.68 164.26 18.72 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.202 0.201 . . . . 0.0 110.471 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.665 HD11 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt -66.48 -78.74 0.05 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.405 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' CYS . . . . . 0.613 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.613 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.453 HG23 ' O ' ' A' ' 15' ' ' ASP . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.665 ' HA2' HD11 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.453 ' O ' HG23 ' A' ' 13' ' ' ILE . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.616 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.813 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.646 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.629 HD23 HD13 ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.638 ' HE3' HD23 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . 0.766 HG12 ' HG ' ' A' ' 47' ' ' LEU . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.431 ' HB2' ' HA3' ' A' ' 44' ' ' GLY . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.405 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.9 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.646 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.857 ' HH2' ' HA ' ' A' ' 42' ' ' GLU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.914 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.914 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.574 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.596 ' HB2' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.52 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.13 -3.58 0.48 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 89.4 m -104.88 -125.47 0.22 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 117.871 0.836 . . . . 0.0 110.744 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.51 ' CZ ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -171.7 92.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -176.249 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.63 ' O ' ' HG3' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -70.37 93.64 0.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 0.0 110.563 176.906 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.8 52.57 0.86 Allowed Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.857 ' HA ' ' HH2' ' A' ' 26' ' ' TRP . 2.9 pp20? -74.56 178.75 5.11 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -173.122 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.3 p -161.57 25.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 122.238 1.018 . . . . 0.0 109.451 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.431 ' HA3' ' HB2' ' A' ' 23' ' ' ASP . . . -121.07 -167.17 13.2 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.091 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -124.54 -37.46 2.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.86 0.33 . . . . 0.0 111.408 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -76.87 66.35 2.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -175.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.766 ' HG ' HG12 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -157.49 151.64 24.65 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 175.127 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.572 ' H ' HD23 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -77.75 91.33 4.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 178.439 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.859 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.41 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.859 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.596 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.705 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.858 ' HG2' ' HB3' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.563 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.705 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.592 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -59.91 -35.02 73.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.616 HD11 HH11 ' A' ' 57' ' ' ARG . 3.7 tp -69.4 -19.07 63.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.122 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.67 -19.77 25.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.77 -175.922 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -122.37 -45.55 2.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -175.404 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.98 38.37 1.82 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.182 -1.009 . . . . 0.0 112.742 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.549 ' HA3' HD13 ' A' ' 61' ' ' LEU . . . -117.81 -104.96 2.28 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.323 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.17 41.29 3.55 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 28.78 44.04 0.04 OUTLIER Glycine 0 C--N 1.343 0.956 0 O-C-N 124.358 1.036 . . . . 0.0 114.818 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.445 ' O ' ' HG ' ' A' ' 61' ' ' LEU . . . 138.5 -122.03 2.3 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' HIS . . . . . 0.625 ' CG ' ' H ' ' A' ' 70' ' ' MET . 8.4 t-80 -179.96 -147.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.625 ' H ' ' CG ' ' A' ' 69' ' ' HIS . 0.4 OUTLIER -103.97 -16.97 15.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.361 175.458 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -149.66 107.83 0.37 Allowed Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.539 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . 0.423 ' HB3' ' HA3' ' A' ' 86' ' ' GLY . 0.1 OUTLIER -93.11 106.59 18.53 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.222 0.209 . . . . 0.0 110.485 -179.084 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -49.23 112.04 1.19 Allowed Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.694 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 167.65 -129.0 1.81 Allowed Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 -176.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.97 94.83 2.81 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.096 0.474 . . . . 0.0 111.214 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 15.3 t -131.98 110.45 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.52 176.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.453 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 19.6 mtt -79.43 97.89 6.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.805 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.524 HG12 ' HA ' ' A' ' 81' ' ' GLU . 12.9 p 171.46 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.899 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.32 -41.43 83.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.17 60.55 4.83 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.292 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.524 ' HA ' HG12 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -53.64 125.75 46.56 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.19 -177.08 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HD2' HD21 ' A' ' 84' ' ' LEU . 16.9 Cg_exo -70.2 -170.18 0.4 Allowed 'Trans proline' 0 CA--C 1.529 0.234 0 C-N-CA 122.972 2.448 . . . . 0.0 112.132 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.39 63.66 1.82 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.472 -178.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.506 ' H ' HD22 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -70.93 -179.44 2.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.633 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -46.6 58.11 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . 48.21 -117.15 3.49 Favored Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 113.37 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 151.76 -41.56 0.73 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.794 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.59 102.25 13.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -106.47 -150.12 0.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.288 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.49 94.66 0.16 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.1 -0.572 . . . . 0.0 111.68 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.858 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -68.03 -92.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.912 0.085 . . . . 0.0 111.061 -177.398 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 67.94 -13.23 0.27 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.24 0.616 . . . . 0.0 112.323 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASP . . . . . 0.49 ' H ' ' C ' ' A' ' 91' ' ' ASP . 13.9 p-10 -77.16 -31.65 55.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.259 -176.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.03 156.01 45.89 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.059 0.457 . . . . 0.0 110.903 -179.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.23 130.29 39.9 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.551 179.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt -101.84 -175.06 2.74 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.734 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.629 HD13 HD23 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.402 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.541 ' HD2' ' HA ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.638 HD23 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.813 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . 0.616 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 48.2 t-20 -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m -84.28 -59.66 2.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -84.11 46.42 1.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.73 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.435 ' HB2' ' HD3' ' A' ' 16' ' ' ARG . 30.2 t80 -83.03 -71.39 0.5 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.18 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.07 -74.74 0.09 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.913 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 51.03 64.3 1.9 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.012 173.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -94.81 -149.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.67 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -120.81 44.62 2.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.136 0.493 . . . . 0.0 110.804 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.5 -146.37 4.48 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.833 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ILE . . . . . 0.509 HG22 HD11 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -107.89 25.27 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.091 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -102.5 9.69 39.37 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.505 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.42 98.08 10.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.743 177.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.345 -176.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 121.133 0.492 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.807 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.593 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.807 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.595 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.555 ' O ' HD22 ' A' ' 19' ' ' LEU . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.944 HD12 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' GLN . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.837 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.579 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' CD1' HG21 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.55 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.486 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 35' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.51 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--O 1.236 0.355 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.944 ' HB ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.458 ' O ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m . . . . . 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 12' ' ' ASN . 4.0 mt . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.535 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.717 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.757 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.731 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.494 ' HG ' ' HG2' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.517 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.704 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.704 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 31' ' ' LEU . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.527 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.808 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.892 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD12 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.504 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.782 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.436 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.782 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.892 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.468 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.517 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.731 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.777 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.554 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.537 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 1.017 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.907 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 4.8 pm0 -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.907 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.931 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.931 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.739 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.99 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.482 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.99 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.739 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.53 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' H ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 1.017 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.513 ' HG3' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.537 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.816 HD12 ' HB2' ' A' ' 4' ' ' LEU . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.461 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.549 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 97' ' ' ILE . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.568 HD11 HD21 ' A' ' 31' ' ' LEU . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.453 ' H ' ' H ' ' A' ' 24' ' ' GLN . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.453 ' H ' ' H ' ' A' ' 23' ' ' ASP . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.842 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.467 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 HD11 ' A' ' 22' ' ' ILE . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.719 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.168 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.736 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.516 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.49 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.508 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.469 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.66 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.545 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.46 ' HG ' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.614 HG22 ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.613 HD21 HG23 ' A' ' 103' ' ' THR . 1.1 mp . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.677 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.513 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.795 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 28' ' ' GLU . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.816 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.531 ' HB3' HG12 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.741 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.3 pm0 -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.816 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CD2' HD21 ' A' ' 31' ' ' LEU . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.795 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.432 HD21 ' CD2' ' A' ' 26' ' ' TRP . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.845 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.676 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.588 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.845 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.476 ' N ' ' OD1' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.676 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.408 HD21 ' HA ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.741 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.516 ' N ' HG22 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.424 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.613 HG23 HD21 ' A' ' 3' ' ' LEU . 1.2 m . . . . . 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.662 0.268 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.758 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.732 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.732 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.758 HD12 ' HB2' ' A' ' 4' ' ' LEU . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.403 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.615 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.721 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.968 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.625 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.968 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.625 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.721 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.951 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.951 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 80.1 t80 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-O 120.964 0.411 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.871 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.871 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.673 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.497 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.673 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.416 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.563 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.789 0.328 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.557 ' HD2' HD21 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.794 HD13 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.748 0.308 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.624 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.468 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.554 HD12 ' HB2' ' A' ' 4' ' ' LEU . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.6 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.629 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.581 HD22 HG22 ' A' ' 97' ' ' ILE . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.992 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.592 ' HB3' ' C ' ' A' ' 96' ' ' LEU . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.71 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 55' ' ' LEU . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.695 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.887 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.562 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.825 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 60' ' ' TYR . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.611 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.887 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.611 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.581 HG22 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.6 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.629 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.431 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.428 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.887 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.887 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 3' ' ' LEU . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' CD2' ' A' ' 27' ' ' HIS . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.591 ' O ' HD22 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.591 HD22 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.015 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ASP . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.473 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 1.015 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.516 HD13 ' CG2' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.925 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 59' ' ' ASP . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.925 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 . . . . . 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 1.017 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.482 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 1.017 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.503 HD22 ' HB2' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' CG ' HD23 ' A' ' 35' ' ' LEU . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.761 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.483 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.862 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.627 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.761 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.915 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.948 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.552 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.436 ' H ' ' H ' ' A' ' 24' ' ' GLN . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.436 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.948 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 1.041 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.692 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.755 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HB2' HD22 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.862 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.041 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.412 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.755 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.559 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.915 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.695 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.401 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.417 HD12 ' HB2' ' A' ' 4' ' ' LEU . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.883 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.616 HD22 ' HB ' ' A' ' 97' ' ' ILE . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.773 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.462 ' H ' ' H ' ' A' ' 24' ' ' GLN . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.773 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.749 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.851 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.771 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.616 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.41 ' O ' HD23 ' A' ' 19' ' ' LEU . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.883 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.49 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.424 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.9 OUTLIER 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.519 HG23 ' NE2' ' A' ' 27' ' ' HIS . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.629 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.656 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.982 HD22 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.435 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.938 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 56' ' ' CYS . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.405 ' HE2' ' HG3' ' A' ' 57' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.523 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.523 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.536 ' SG ' ' HB2' ' A' ' 58' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.651 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.536 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.651 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.982 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.74 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.74 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.485 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.504 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.9 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.9 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.84 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.673 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.673 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 1.056 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.5 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.467 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 1.056 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 60' ' ' TYR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.61 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.638 0.256 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.75 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.485 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.479 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' H ' ' A' ' 103' ' ' THR . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.4 ' H ' ' HB3' ' A' ' 102' ' ' ASN . 1.8 m . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-O 120.865 0.364 . . . . 0.0 110.431 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.571 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.6 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.536 HD12 ' HG ' ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.688 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.611 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.829 HD22 ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.852 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.852 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.406 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 23.0 m-70 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.64 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.778 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 CA-C-O 120.88 0.371 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.696 ' HB2' HD22 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.681 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.696 HD22 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.829 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.812 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.611 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.688 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t . . . . . 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 C--O 1.232 0.173 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.56 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.63 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.63 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.56 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.538 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.595 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.877 HD21 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 1.005 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.497 HD12 ' CZ2' ' A' ' 26' ' ' TRP . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 1.005 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.919 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD12 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.919 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.455 -0.175 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 1.021 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.543 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 1.021 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.593 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HD3' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.441 ' H ' ' HB2' ' A' ' 56' ' ' CYS . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.449 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.438 ' C ' HG13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.877 ' HD2' HD21 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' HD21 ' A' ' 12' ' ' ASN . 1.2 mt . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.473 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.645 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.44 HD21 ' HB2' ' A' ' 3' ' ' LEU . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.438 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.545 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.402 ' HD2' ' HE ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.856 HD22 ' HB ' ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.667 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.667 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.875 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.493 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.819 ' HB3' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 22' ' ' ILE . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.51 ' HB2' HD23 ' A' ' 55' ' ' LEU . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.468 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.529 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.819 HD13 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.656 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.9 mt . . . . . 0 N--CA 1.461 0.09 0 CA-C-O 120.789 0.328 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.856 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.58 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.473 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.439 ' HB ' ' OE1' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.688 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.552 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 1.6 pp0? -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.552 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.473 HD12 ' CB ' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.42 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.641 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.74 HD22 HD13 ' A' ' 97' ' ' ILE . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.722 HD13 ' HG2' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.414 HD13 ' CD1' ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.531 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 57' ' ' ARG . 1.4 t80 . . . . . 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.449 ' HB3' ' N ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.722 ' HG2' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.436 ' HG3' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.449 ' N ' ' HB3' ' A' ' 49' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.74 HD13 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.586 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.61 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.61 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' A' ' 27' ' ' HIS . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.646 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.954 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 96' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.954 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HE1' HG13 ' A' ' 22' ' ' ILE . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.573 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.573 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.846 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.543 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.846 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.634 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 120.508 0.194 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.753 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.512 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.646 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.569 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.584 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.584 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.569 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.88 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.575 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 97' ' ' ILE . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.402 ' HB3' ' H ' ' A' ' 33' ' ' CYS . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.742 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.594 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.742 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.47 ' CE1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.146 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.849 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.762 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.806 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.689 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.531 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.806 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LEU . . . . . 0.434 ' C ' HG13 ' A' ' 97' ' ' ILE . 30.4 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.565 0.221 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.739 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.88 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.423 HD21 HD22 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.764 HD13 HD21 ' A' ' 102' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.198 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.696 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 8.5 t-20 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.738 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.867 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.557 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.616 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.867 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.616 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.89 ' HA ' HD12 ' A' ' 19' ' ' LEU . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.439 HD12 ' CG ' ' A' ' 26' ' ' TRP . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.509 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.547 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.539 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 5.4 m-85 . . . . . 0 CA--C 1.512 -0.497 0 CA-C-O 120.68 0.276 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.485 ' HG3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 60' ' ' TYR . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.777 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.553 HH11 ' HE1' ' A' ' 60' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.89 ' HB2' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.777 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 49' ' ' TYR . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.646 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.764 HD21 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.465 HD12 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLY . . . . . 0.425 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' CYS . . . . . 0.625 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.625 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.423 HG23 ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' HD12 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.636 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.816 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.648 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.971 HD22 ' HB ' ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.662 ' HE3' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . 0.708 HD11 HD11 ' A' ' 31' ' ' LEU . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.42 ' H ' ' H ' ' A' ' 24' ' ' GLN . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.425 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.0 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.648 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.594 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.802 HD12 HG21 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.882 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.882 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.58 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.694 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.971 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 98' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.532 ' HA ' ' HD2' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.662 HD22 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . 0.816 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.636 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 0.2 OUTLIER -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 N-CA-C 112.001 -0.44 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.504 ' HA ' ' OD1' ' A' ' 12' ' ' ASN . 1.3 m -82.86 121.04 26.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.148 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.687 HD21 ' HG3' ' A' ' 104' ' ' GLN . 0.5 OUTLIER -115.77 -67.17 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.242 179.549 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.807 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.593 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.807 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.443 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.595 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.555 ' O ' HD22 ' A' ' 19' ' ' LEU . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.944 HD12 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.472 ' HB3' HD13 ' A' ' 47' ' ' LEU . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' GLN . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.837 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.579 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' CD1' HG21 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.94 42.21 8.27 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.6 p -110.68 -118.22 0.29 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' C ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -170.83 43.66 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.278 177.507 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 97' ' ' ILE . 0.0 OUTLIER 43.01 -112.7 0.22 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.712 176.541 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.64 ' O ' ' HA ' ' A' ' 96' ' ' LEU . . . -172.84 89.09 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -71.31 56.05 0.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.607 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 2.7 t -122.24 92.45 2.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -40.01 112.56 0.3 Allowed Glycine 0 C--N 1.328 0.136 0 CA-C-N 114.956 -1.02 . . . . 0.0 114.548 -171.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.438 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -158.97 -93.08 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.438 ' H ' ' HB3' ' A' ' 45' ' ' ARG . 1.1 mmp_? -104.12 -169.85 1.69 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.833 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.758 HD21 HG12 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -155.65 148.79 24.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.897 0.379 . . . . 0.0 110.578 173.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.749 ' HB2' ' HA ' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -129.38 119.07 23.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.361 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.55 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.805 ' HA ' HH12 ' A' ' 95' ' ' ARG . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.641 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.575 HH11 HD22 ' A' ' 61' ' ' LEU . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 35' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.51 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -66.25 -30.55 71.01 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 3.7 tp -75.32 -17.0 60.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.138 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -20.98 37.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.535 -176.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -120.63 -43.85 2.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.72 39.18 2.02 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.144 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -124.21 -112.96 2.01 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.433 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.411 ' H ' ' HG ' ' A' ' 61' ' ' LEU . 13.7 m -142.61 9.37 1.79 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 111.453 0.168 . . . . 0.0 111.453 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.607 ' HA3' ' HG2' ' A' ' 88' ' ' GLU . . . -106.72 -122.34 4.91 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 119.703 -1.237 . . . . 0.0 113.04 -176.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.81 35.39 9.2 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.225 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -125.25 -171.75 2.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.74 -48.07 5.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.86 0.362 . . . . 0.0 110.084 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.409 ' O ' ' HA3' ' A' ' 86' ' ' GLY . . . -69.79 108.86 2.63 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.22 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.23 159.23 16.26 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.739 ' HA3' ' O ' ' A' ' 83' ' ' THR . . . 107.16 -160.97 13.91 Favored Glycine 0 C--O 1.218 -0.862 0 CA-C-N 116.396 -0.366 . . . . 0.0 112.431 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.942 ' H ' ' HA ' ' A' ' 84' ' ' LEU . . . -93.46 148.45 19.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -72.99 95.09 1.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.087 0.443 . . . . 0.0 110.999 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.34 164.49 26.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.816 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 49.2 mtm -52.98 129.98 32.23 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 123.389 0.43 . . . . 0.0 111.086 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.3 t -76.25 99.58 2.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.951 0.405 . . . . 0.0 110.848 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -111.56 -2.05 10.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.432 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 94.41 44.13 3.54 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.339 -0.705 . . . . 0.0 111.339 -177.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.01 156.5 42.68 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.89 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.97 166.06 29.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.848 2.365 . . . . 0.0 111.382 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.739 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 0.2 OUTLIER 53.11 -96.5 0.05 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.836 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.942 ' HA ' ' H ' ' A' ' 74' ' ' GLY . 0.4 OUTLIER -51.08 95.93 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -172.297 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.47 -47.25 0.42 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.754 172.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 71' ' ' GLY . . . -123.99 -102.62 1.52 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 120.832 -0.699 . . . . 0.0 114.064 -174.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -144.38 -29.72 0.1 Allowed Glycine 0 C--N 1.336 0.58 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.94 -175.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.607 ' HG2' ' HA3' ' A' ' 67' ' ' GLY . 3.1 mt-10 -86.48 93.14 9.07 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.523 0.661 . . . . 0.0 109.903 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' HA ' ' HA2' ' A' ' 73' ' ' GLY . 22.4 m-85 -59.54 -153.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -116.11 -111.02 2.72 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.964 -172.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.859 ' HA ' ' HG3' ' A' ' 94' ' ' GLU . 5.4 p-10 -122.65 -109.0 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 122.539 -0.389 . . . . 0.0 112.007 -173.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 16.7 mm-40 76.85 -44.92 0.48 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.177 0.991 . . . . 0.0 110.951 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -119.89 3.54 11.04 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.13 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.859 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 2.3 mm-40 -78.03 -163.49 0.43 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.473 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.805 HH12 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -67.75 73.78 0.17 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.091 -175.516 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HA ' ' O ' ' A' ' 41' ' ' GLY . 1.5 mt -95.81 76.39 3.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.944 ' HB ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.458 ' O ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m -63.35 -42.27 98.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.687 ' HG3' HD21 ' A' ' 3' ' ' LEU . 31.7 mt-30 -95.07 61.24 2.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.284 172.166 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.443 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -72.13 -24.58 61.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.955 -178.015 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -4.16 -68.39 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.045 1.738 . . . . 0.0 114.127 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.577 ' HB1' ' O ' ' A' ' 110' ' ' GLY . . . 72.32 64.02 0.12 Allowed 'General case' 0 C--O 1.233 0.203 0 O-C-N 124.254 0.971 . . . . 0.0 110.303 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.8 65.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.069 -175.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -125.33 45.64 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.043 0.449 . . . . 0.0 110.865 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.577 ' O ' ' HB1' ' A' ' 107' ' ' ALA . . . 73.86 -111.75 3.56 Favored Glycine 0 C--O 1.226 -0.36 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.0 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -94.64 43.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.887 0.851 . . . . 0.0 109.777 175.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -160.46 137.91 9.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.597 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -119.63 172.82 7.4 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.92 0.391 . . . . 0.0 111.381 -177.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.248 0.987 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.932 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.9 162.29 14.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 12' ' ' ASN . 4.0 mt -74.51 163.92 27.2 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.535 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.717 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.757 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.731 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.494 ' HG ' ' HG2' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.517 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.704 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.704 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 31' ' ' LEU . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.527 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.808 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.892 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . 84.71 15.64 67.6 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -78.02 -90.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.078 0.466 . . . . 0.0 110.139 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -165.64 144.09 6.05 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 176.255 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -69.91 120.6 15.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.061 0.458 . . . . 0.0 111.483 -175.032 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 112.61 -57.97 0.42 Allowed Glycine 0 N--CA 1.442 -0.937 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.505 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 39' ' ' ARG . 11.2 mm-40 49.63 -107.56 0.26 Allowed 'General case' 0 CA--C 1.53 0.196 0 O-C-N 124.058 0.505 . . . . 0.0 110.785 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -100.25 86.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 172.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.02 166.37 17.18 Favored Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.806 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.78 9.01 7.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.085 0.469 . . . . 0.0 110.515 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.98 92.01 8.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.104 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.695 HD12 HH22 ' A' ' 95' ' ' ARG . 0.2 OUTLIER -86.92 85.23 7.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.27 0.557 . . . . 0.0 111.03 -177.643 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -94.79 162.51 13.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.354 173.511 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD12 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.504 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.782 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.482 ' NH2' ' HB2' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.782 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.892 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.468 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.83 -42.06 50.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.592 ' HB3' ' O ' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -74.18 -49.7 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.501 -177.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.456 HH11 ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -164.08 -86.44 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 175.846 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' HB3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -125.58 -39.67 2.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 168.016 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.423 ' O ' ' HA ' ' A' ' 58' ' ' ARG . . . -120.62 -61.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.689 174.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 61' ' ' LEU . . . -142.39 -107.54 0.63 Allowed Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.871 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.37 -20.1 20.68 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.768 -0.216 . . . . 0.0 110.593 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 26.05 43.39 0.02 OUTLIER Glycine 0 N--CA 1.467 0.761 0 O-C-N 124.295 0.997 . . . . 0.0 115.573 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -116.23 -55.8 0.33 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.724 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -124.8 -91.65 0.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.594 0.235 . . . . 0.0 110.546 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 mtp -107.65 -34.92 6.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.018 0.437 . . . . 0.0 110.742 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.88 118.78 3.66 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.148 -174.125 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB2' ' CA ' ' A' ' 86' ' ' GLY . 0.0 OUTLIER -94.09 5.79 50.61 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -172.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.446 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -103.32 -51.7 0.97 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.233 174.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.12 167.94 24.98 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.075 -0.583 . . . . 0.0 111.975 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.23 119.47 15.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.922 0.391 . . . . 0.0 109.987 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.12 120.41 46.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.938 -174.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.78 158.95 22.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.454 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.7 t -81.25 66.82 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.308 0.575 . . . . 0.0 109.956 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -135.37 9.96 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.012 -174.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.85 78.09 1.04 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -59.34 123.89 72.37 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.932 0.396 . . . . 0.0 111.669 -174.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.479 ' O ' ' HA3' ' A' ' 90' ' ' GLY . 88.0 Cg_endo -86.34 -175.6 1.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.922 2.415 . . . . 0.0 112.457 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 t -92.16 118.55 30.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.289 0.566 . . . . 0.0 110.336 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.61 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . 1.1 mt -119.38 124.8 47.48 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.665 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.78 22.63 7.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.209 0.528 . . . . 0.0 111.068 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.577 ' CA ' ' HB2' ' A' ' 72' ' ' SER . . . -98.66 -128.72 6.24 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.792 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 72' ' ' SER . . . -85.52 -71.69 1.31 Allowed Glycine 0 C--O 1.225 -0.421 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.12 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.472 ' CG ' ' HA3' ' A' ' 65' ' ' GLY . 2.5 mp0 -83.75 96.96 8.89 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 122.519 -0.4 . . . . 0.0 110.709 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.61 ' HA ' ' HB2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -77.79 167.51 21.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.224 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 82' ' ' PRO . . . -97.14 -106.92 2.44 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.352 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.716 ' HB2' ' HG2' ' A' ' 94' ' ' GLU . 30.4 p-10 -86.91 -84.31 0.18 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.619 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 4.3 mt-10 67.57 -45.41 0.49 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.572 1.149 . . . . 0.0 112.531 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -135.92 35.16 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.582 0.705 . . . . 0.0 110.055 -177.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.716 ' HG2' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -77.37 161.56 27.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.494 -179.574 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.695 HH22 HD12 ' A' ' 47' ' ' LEU . 1.9 ttp-105 -157.87 -174.01 4.64 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt -108.29 -172.19 2.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.517 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.731 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' A' ' 113' ' ' ASP . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -104.91 0.4 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -168.19 93.51 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 175.813 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.65 -57.71 1.12 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 -172.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -69.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.002 -174.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -139.31 -6.6 1.37 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 104' ' ' GLN . . . -68.29 -11.13 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.863 0.364 . . . . 0.0 111.231 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ASN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 104' ' ' GLN . 9.0 t-20 -117.12 32.19 6.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 110.071 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -165.61 -68.54 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.532 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.417 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 2.5 mm -98.19 -101.88 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.907 0.384 . . . . 0.0 110.382 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.417 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 28.9 t0 -153.82 131.86 11.76 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.456 ' HB2' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -56.87 120.13 7.4 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.405 0.44 . . . . 0.0 110.923 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 -175.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.09 124.81 28.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.742 0.306 . . . . 0.0 110.805 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt -102.43 -66.56 0.92 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.777 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.554 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.537 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.017 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.907 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 4.8 pm0 -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.907 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.931 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.931 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 122.43 13.29 4.81 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -112.51 -98.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.264 0.532 . . . . 0.0 110.886 178.267 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.99 32.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.966 0.412 . . . . 0.0 110.453 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.66 59.4 4.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.015 0.436 . . . . 0.0 110.975 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 74.26 40.4 41.34 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.596 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 58.58 -91.58 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.436 0.695 . . . . 0.0 111.698 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.98 129.44 37.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.772 0.32 . . . . 0.0 110.278 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.506 ' HA3' HD11 ' A' ' 97' ' ' ILE . . . -76.59 90.77 0.95 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.677 -177.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 4.3 ttm180 -113.91 -32.16 6.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.19 0.519 . . . . 0.0 110.195 179.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -121.64 80.78 1.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.395 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.62 106.48 8.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.322 0.582 . . . . 0.0 110.552 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.739 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -124.28 127.12 47.18 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.39 176.092 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.99 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.482 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.99 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.739 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.53 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -61.46 -33.65 74.12 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -61.84 -20.89 64.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.889 -176.106 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -25.71 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -116.41 -38.86 3.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.618 -179.092 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.91 -10.32 40.4 Favored Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.388 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.531 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -114.26 41.57 2.15 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.484 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 m 28.95 43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.025 0.93 . . . . 0.0 113.498 -174.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 25.91 41.91 0.01 OUTLIER Glycine 0 C--N 1.347 1.172 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 58.52 35.87 82.15 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.075 176.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.27 -62.77 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.507 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.34 -15.61 21.78 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.01 177.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 106.56 -30.58 9.3 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -174.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -91.85 178.55 5.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.985 -0.608 . . . . 0.0 110.353 176.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 83' ' ' THR . . . 178.74 -166.23 35.84 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 89' ' ' PHE . . . 143.76 165.53 10.89 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.198 -1.001 . . . . 0.0 112.507 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -94.99 127.09 40.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 81' ' ' GLU . 15.6 t -72.18 98.66 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 5.9 mtt -82.01 154.36 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.909 -177.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.42 -15.66 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.335 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -79.53 15.4 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 111.213 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.08 39.49 37.31 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 76' ' ' VAL . 0.6 OUTLIER -114.25 99.16 50.4 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 83' ' ' THR . 69.3 Cg_endo -88.79 -144.81 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.888 2.392 . . . . 0.0 112.11 -177.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.583 HG22 ' HA2' ' A' ' 73' ' ' GLY . 0.0 OUTLIER -60.22 116.67 4.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.913 0.387 . . . . 0.0 111.183 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 72' ' ' SER . 1.1 mp -79.41 127.33 31.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.081 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.406 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 0.0 OUTLIER -80.67 6.93 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.659 -175.741 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.2 -0.35 65.66 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.322 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.76 84.94 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.745 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -79.42 105.28 10.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.929 0.395 . . . . 0.0 110.552 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.54 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 13.8 m-85 -81.99 -165.17 0.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.012 -176.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -83.66 36.68 2.8 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.866 -0.683 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.42 -112.62 0.1 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.855 0.359 . . . . 0.0 110.163 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.1 -67.31 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 27.1 t70 -140.73 -34.83 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.887 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.685 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 3.7 tt0 73.9 106.37 0.07 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.859 0.837 . . . . 0.0 110.92 -177.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.18 -145.42 0.21 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.83 -176.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' H ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -155.62 -139.31 0.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.419 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 1.017 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.513 ' HG3' HH11 ' A' ' 99' ' ' ARG . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.537 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.468 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -83.78 -96.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.468 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.7 OUTLIER -168.33 86.63 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.9 70.52 1.47 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.195 0.521 . . . . 0.0 111.429 -175.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.429 ' HB2' ' OE2' ' A' ' 101' ' ' GLU . 6.2 t70 -124.99 -56.5 1.56 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.113 176.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 65.53 31.13 10.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.038 -1.437 . . . . 0.0 110.446 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.1 24.19 14.32 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.931 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -113.1 -5.8 13.71 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.099 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -114.51 -75.63 0.66 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.936 178.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.92 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.102 0.477 . . . . 0.0 110.192 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -166.44 138.92 3.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.637 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -71.24 119.0 14.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.895 0.379 . . . . 0.0 110.767 -178.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.013 -179.502 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.39 155.62 31.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.972 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.55 -172.29 4.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.876 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.816 HD12 ' HB2' ' A' ' 4' ' ' LEU . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.549 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 97' ' ' ILE . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.785 HD13 HD22 ' A' ' 47' ' ' LEU . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.453 ' H ' ' H ' ' A' ' 24' ' ' GLN . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.453 ' H ' ' H ' ' A' ' 23' ' ' ASP . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.842 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.467 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 HD11 ' A' ' 22' ' ' ILE . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.504 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.719 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.83 33.04 0.82 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.438 ' HB2' ' H ' ' A' ' 39' ' ' ARG . 3.0 m -90.35 -111.17 0.08 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.312 0.556 . . . . 0.0 110.126 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' SER . 0.3 OUTLIER -178.33 169.33 1.83 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.707 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -136.55 147.76 47.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.24 -0.57 1.4 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.553 -174.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.935 ' HB2' HD13 ' A' ' 96' ' ' LEU . 1.3 mp0 -86.08 171.69 11.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.926 0.363 . . . . 0.0 110.239 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.756 HG22 ' HA ' ' A' ' 98' ' ' THR . 60.6 t -133.37 138.47 51.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.373 -175.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -173.55 5.68 0.03 OUTLIER Glycine 0 CA--C 1.529 0.943 0 C-N-CA 119.227 -1.463 . . . . 0.0 115.372 172.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 95' ' ' ARG . 9.3 ttm180 176.04 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.077 0.939 . . . . 0.0 110.412 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 ptp180 -163.79 -1.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.785 HD22 HD13 ' A' ' 22' ' ' ILE . 11.3 tp 151.34 142.42 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.169 1.388 . . . . 0.0 108.414 171.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.82 90.71 3.71 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.832 -1.147 . . . . 0.0 110.168 170.268 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.778 ' HD2' HD23 ' A' ' 47' ' ' LEU . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.516 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.49 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.508 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.469 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.66 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.545 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -62.6 -38.87 91.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' ' H ' ' A' ' 66' ' ' SER . 0.5 OUTLIER -66.32 -24.49 66.54 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.349 -179.647 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.45 HH12 ' CD ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -66.42 -24.77 66.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.468 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -117.87 -34.61 4.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.664 -177.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -122.13 18.51 8.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.341 -0.933 . . . . 0.0 113.594 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.545 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -132.36 -112.68 1.41 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 120.096 -1.049 . . . . 0.0 111.944 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.675 ' H ' ' HG ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -138.78 20.67 2.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.906 0.384 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.633 ' HA2' ' HA2' ' A' ' 71' ' ' GLY . . . -82.45 -36.45 16.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.554 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -79.14 -25.01 60.35 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.534 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -78.53 -65.96 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.121 0.486 . . . . 0.0 109.905 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.734 ' HB3' ' HA3' ' A' ' 74' ' ' GLY . 0.6 OUTLIER -106.83 -64.02 1.22 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.714 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.633 ' HA2' ' HA2' ' A' ' 67' ' ' GLY . . . 99.61 -126.22 8.84 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.758 -0.735 . . . . 0.0 111.995 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.82 70.46 6.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 110.14 177.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 100.79 -70.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.324 -174.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.734 ' HA3' ' HB3' ' A' ' 70' ' ' MET . . . 87.13 -106.24 3.14 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.169 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -113.68 135.11 54.29 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.902 0.382 . . . . 0.0 110.631 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 17.4 t -70.6 108.51 2.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.146 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.593 ' HG3' ' HA ' ' A' ' 82' ' ' PRO . 5.9 mtt -64.95 154.7 36.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.853 -176.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.9 m -61.65 -7.39 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.135 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.62 -14.62 15.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.149 0.499 . . . . 0.0 110.307 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.83 -5.39 29.2 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 pt-20 -156.95 148.99 17.52 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.593 ' HA ' ' HG3' ' A' ' 77' ' ' MET . 2.7 Cg_exo -75.77 -139.58 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.123 2.549 . . . . 0.0 111.236 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.453 HG21 ' HZ ' ' A' ' 89' ' ' PHE . 2.2 p -77.56 -100.12 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.571 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -119.68 172.83 7.4 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 171.324 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -46.6 81.76 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.81 69.24 0.72 Allowed Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 166.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.36 13.99 2.57 Favored Glycine 0 C--N 1.33 0.224 0 N-CA-C 114.271 0.468 . . . . 0.0 114.271 -170.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.45 ' CD ' HH12 ' A' ' 62' ' ' ARG . 20.3 mt-10 -91.91 73.43 5.66 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.571 ' HD1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -63.75 -178.29 0.29 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.773 -174.298 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.51 -92.33 2.09 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.582 ' OD2' ' HB2' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -122.13 -80.19 0.62 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.876 0.37 . . . . 0.0 110.086 177.765 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -48.13 2.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.08 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -141.09 10.88 2.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.632 177.267 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.821 ' HB3' HD12 ' A' ' 96' ' ' LEU . 10.9 mt-10 81.58 104.86 0.06 Allowed 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.486 1.114 . . . . 0.0 110.991 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 45' ' ' ARG . 1.7 ttm180 -76.87 -0.65 24.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.474 -1.239 . . . . 0.0 112.149 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.935 HD13 ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -32.02 154.67 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -171.738 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 43' ' ' VAL . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.756 ' HA ' HG22 ' A' ' 43' ' ' VAL . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.3 OUTLIER -108.45 -94.68 0.4 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.509 ' H ' ' HB ' ' A' ' 103' ' ' THR . 3.6 pt20 -164.07 59.46 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.069 0.462 . . . . 0.0 111.045 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.586 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -125.38 80.88 1.92 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.069 0.462 . . . . 0.0 110.967 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.92 -50.66 10.82 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.174 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.88 20.17 2.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.75 -177.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -86.73 5.13 37.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.476 0.655 . . . . 0.0 110.186 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -86.18 36.75 0.69 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.31 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.2 17.97 48.3 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.418 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.548 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -105.66 -106.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.68 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.548 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 25.2 t70 -172.72 104.79 0.15 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.424 175.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.491 ' HB3' ' HE1' ' A' ' 105' ' ' PHE . 1.4 t70 -107.68 169.79 8.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.806 -178.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.164 -0.375 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.3 -38.44 65.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.258 0.551 . . . . 0.0 110.695 -178.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.613 HD21 HG23 ' A' ' 103' ' ' THR . 1.1 mp -108.93 -142.3 0.38 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.923 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.677 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' ' HB ' ' A' ' 43' ' ' VAL . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.513 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HB2' ' HA ' ' A' ' 105' ' ' PHE . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.795 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 28' ' ' GLU . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.816 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.531 ' HB3' HG12 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.741 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HB3' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.464 HE22 ' HB3' ' A' ' 45' ' ' ARG . 2.3 pm0 -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.816 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.52 ' HZ2' ' HB2' ' A' ' 46' ' ' ARG . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.795 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.717 HD22 HD23 ' A' ' 47' ' ' LEU . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.662 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.549 ' OD1' ' HB3' ' A' ' 40' ' ' LEU . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.26 36.62 93.45 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.0 m -63.52 -72.09 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.74 -34.72 9.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.882 0.372 . . . . 0.0 110.025 173.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.662 ' CD1' ' H ' ' A' ' 32' ' ' SER . 15.3 mt -75.67 -128.28 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.805 177.278 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.481 ' H ' ' HB3' ' A' ' 40' ' ' LEU . . . 93.38 49.61 2.55 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -176.239 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.506 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 51.85 71.07 0.48 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.305 0.574 . . . . 0.0 111.532 -176.096 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 8' ' ' GLY . 1.8 m -86.54 6.49 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.345 -175.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . 156.88 6.15 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 118.414 -1.85 . . . . 0.0 115.749 168.106 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER 171.17 -78.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.81 1.305 . . . . 0.0 113.66 175.478 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.829 ' HA ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -126.73 -169.87 2.1 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -164.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.848 HD22 ' H ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER 176.77 -173.87 0.11 Allowed 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -174.231 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.848 ' H ' HD22 ' A' ' 47' ' ' LEU . 2.1 t80 -77.71 92.13 4.13 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 166.251 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.845 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.676 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.588 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.845 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.699 HH21 ' HB3' ' A' ' 91' ' ' ASP . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.476 ' N ' ' OD1' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.676 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -67.36 -40.85 85.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.618 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -72.42 -15.07 61.83 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.358 -177.46 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -22.24 60.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.061 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -120.89 -49.19 2.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.858 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.49 33.53 2.64 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.322 -174.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.618 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -76.92 -83.81 0.49 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.109 -1.043 . . . . 0.0 111.317 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.515 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -101.68 -120.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.515 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -115.44 -1.52 21.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.091 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.52 -119.97 6.32 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.544 -177.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 59.59 -99.55 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.658 0.383 . . . . 0.0 111.57 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.5 mtt -83.82 -21.38 32.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.994 0.425 . . . . 0.0 110.655 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.97 96.54 1.04 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.958 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.01 126.8 40.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.101 0.477 . . . . 0.0 110.609 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.646 ' HA3' ' HD1' ' A' ' 89' ' ' PHE . . . 177.31 177.8 46.48 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -178.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 82' ' ' PRO . . . 112.61 172.3 18.66 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.708 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -146.52 130.56 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.847 0.356 . . . . 0.0 110.838 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.547 HG23 HD11 ' A' ' 84' ' ' LEU . 48.2 t -87.52 112.89 24.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.805 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.462 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -55.8 153.0 8.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.098 -176.299 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 77' ' ' MET . 76.1 t 75.62 -55.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.856 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 -35.19 24.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.998 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.96 49.07 9.04 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.595 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.433 ' HB2' ' HB ' ' A' ' 76' ' ' VAL . 1.8 mt-10 -106.11 106.67 57.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.786 0.327 . . . . 0.0 110.259 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 84.9 Cg_endo -88.5 -172.59 0.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 112.99 -175.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 45.26 63.8 1.63 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.547 HD11 HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -84.5 147.42 27.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.393 177.066 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -15.93 62.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.868 -175.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.36 -27.6 71.89 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.33 10.09 85.09 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.489 178.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.66 86.06 5.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 178.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.646 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 0.0 OUTLIER -73.16 143.37 47.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.5 . . . . 0.0 110.502 -179.173 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 175.84 109.31 0.24 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.109 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.699 ' HB3' HH21 ' A' ' 57' ' ' ARG . 1.0 OUTLIER -78.21 -92.02 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.481 0.64 . . . . 0.0 110.798 -178.032 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -124.6 -52.41 1.7 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.275 0.56 . . . . 0.0 109.95 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -140.92 25.24 2.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.12 177.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 2.8 mm-40 60.16 40.26 18.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.764 -170.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 1.0 OUTLIER -161.63 163.56 29.86 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.747 -172.637 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.408 HD21 ' HA ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -87.84 20.12 3.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.741 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.516 ' N ' HG22 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.424 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.613 HG23 HD21 ' A' ' 3' ' ' LEU . 1.2 m -78.36 -81.11 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.62 -67.68 0.12 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.074 174.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -177.14 127.97 0.16 Allowed 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.793 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.34 -42.15 90.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.933 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . . . -94.11 58.6 2.55 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.216 172.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -71.37 -15.13 62.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.338 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -64.84 -35.12 80.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.607 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.91 -147.13 20.3 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.009 -0.615 . . . . 0.0 111.749 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.18 -38.54 3.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.04 0.447 . . . . 0.0 110.412 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -106.02 162.26 13.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.924 176.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.933 ' HA ' ' HB3' ' A' ' 107' ' ' ALA . 4.1 t0 -85.09 99.39 11.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.239 0.542 . . . . 0.0 110.853 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.311 -0.852 . . . . 0.0 109.226 178.306 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.65 155.85 36.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.785 0.326 . . . . 0.0 110.769 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.38 -177.64 4.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.556 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.758 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.732 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.732 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.758 HD12 ' HB2' ' A' ' 4' ' ' LEU . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.615 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.721 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.968 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.625 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.968 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.625 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.721 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.951 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.951 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.1 22.35 74.22 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.627 ' SG ' ' HB3' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -86.64 -98.48 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.828 0.314 . . . . 0.0 110.745 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -172.59 110.04 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.617 0.246 . . . . 0.0 110.958 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.33 -9.61 59.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.139 0.495 . . . . 0.0 110.056 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.438 ' HA3' ' O ' ' A' ' 28' ' ' GLU . . . -81.88 -6.68 88.77 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.675 174.675 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -97.94 -67.13 0.86 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -102.56 100.03 9.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.12 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.53 74.21 0.19 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.463 -173.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -88.13 -26.21 22.59 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.48 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.596 ' HB2' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -136.21 -173.64 3.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.663 175.805 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.84 ' HB2' HG12 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -161.28 127.8 3.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.951 0.405 . . . . 0.0 110.845 178.708 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.705 ' HE1' ' HG2' ' A' ' 92' ' ' GLU . 80.1 t80 -122.42 134.97 54.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.341 174.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.871 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.871 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.673 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.659 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.673 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.42 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.563 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.96 -38.4 78.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.74 HD11 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -61.85 -30.31 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.225 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.506 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -83.61 -21.48 32.54 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -175.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -104.34 -60.64 1.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.605 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.62 -38.41 4.99 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.307 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.598 ' HA2' ' HA ' ' A' ' 61' ' ' LEU . . . 26.15 42.99 0.02 OUTLIER Glycine 0 N--CA 1.467 0.733 0 N-CA-C 116.261 1.264 . . . . 0.0 116.261 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.09 -42.25 97.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.041 0.448 . . . . 0.0 110.445 177.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -87.29 7.79 79.38 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.958 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.74 ' HA3' HD11 ' A' ' 61' ' ' LEU . . . -94.02 -60.36 1.13 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.58 -85.33 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.267 0.627 . . . . 0.0 111.942 175.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.587 ' O ' ' HG3' ' A' ' 77' ' ' MET . 5.2 mtm -68.53 -54.84 14.17 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.409 ' HA3' ' SD ' ' A' ' 77' ' ' MET . . . 90.99 -76.43 1.52 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.022 176.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.25 71.58 2.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 110.944 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.446 ' H ' ' HA2' ' A' ' 87' ' ' GLY . . . 69.36 -107.02 1.96 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.429 -0.669 . . . . 0.0 111.429 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.29 -15.86 16.43 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 174.522 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.39 119.92 20.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 0.0 110.482 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 70' ' ' MET . 2.3 t -75.35 123.86 32.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.524 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.607 ' HB3' ' HB3' ' A' ' 81' ' ' GLU . 3.1 mtm -64.93 159.8 22.03 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.469 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.525 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -90.04 -123.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.648 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.525 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 1.4 t -111.82 -16.86 8.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.921 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.13 67.81 0.22 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 77' ' ' MET . 0.0 OUTLIER -108.27 104.77 54.95 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 121.068 0.461 . . . . 0.0 111.905 -172.545 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.23 -152.38 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.534 2.822 . . . . 0.0 111.885 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.07 85.66 4.27 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 173.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 156.1 15.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.831 -173.441 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.36 -40.02 95.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.841 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.45 -135.17 7.74 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 172.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.446 ' HA2' ' H ' ' A' ' 73' ' ' GLY . . . 53.04 56.08 20.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.553 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.52 83.65 5.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.904 0.383 . . . . 0.0 110.459 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.28 159.43 23.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.421 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -112.11 -118.07 3.63 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.711 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -151.43 -115.33 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.705 ' HG2' ' HE1' ' A' ' 48' ' ' TYR . 8.7 pt-20 -166.52 -54.47 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 175.071 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.561 ' H ' ' HG3' ' A' ' 92' ' ' GLU . 11.8 t70 -140.72 -41.8 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.998 174.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.596 ' OE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 68.8 161.75 0.2 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 124.011 0.819 . . . . 0.0 111.846 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -120.37 -16.84 8.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.554 -177.605 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.418 ' HA ' ' N ' ' A' ' 47' ' ' LEU . 1.8 mp 61.38 -171.14 0.15 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.378 0.424 . . . . 0.0 110.815 -177.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.84 HG12 ' HB2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.557 ' HD2' HD21 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.794 HD13 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m -51.21 -51.3 55.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.14 -40.79 59.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.085 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.447 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -138.1 87.9 2.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.814 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.738 ' HB3' ' HA ' ' A' ' 112' ' ' ASP . 9.3 t70 -99.72 -113.11 0.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.614 178.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 61.44 29.63 18.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.77 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -106.66 -82.41 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.713 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -83.49 -34.38 25.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -104.42 170.24 18.21 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.627 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' ASP . 1.2 mm -92.15 56.1 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.738 ' HA ' ' HB3' ' A' ' 106' ' ' ASP . 12.7 t70 75.01 -58.47 0.57 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.969 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -85.03 90.99 7.97 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.573 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 . . . . . 0 C--O 1.247 0.952 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.152 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.76 0 N-CA-C 112.194 -0.363 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -90.99 136.69 32.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.905 -0.173 . . . . 0.0 110.574 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -73.2 -105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.095 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.624 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.468 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.554 HD12 ' HB2' ' A' ' 4' ' ' LEU . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.498 ' HB2' ' CD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.6 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.629 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.581 HD22 HG22 ' A' ' 97' ' ' ILE . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.992 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.592 ' HB3' ' C ' ' A' ' 96' ' ' LEU . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.71 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 40' ' ' LEU . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 55' ' ' LEU . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.695 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.887 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.09 18.3 72.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.47 -105.87 0.15 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.071 0.435 . . . . 0.0 109.894 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -155.44 38.37 0.39 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.674 0.273 . . . . 0.0 110.375 177.419 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' SG ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 57.12 -105.16 0.25 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.585 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.463 ' H ' ' HB3' ' A' ' 40' ' ' LEU . . . -95.23 2.17 65.37 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.349 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.8 OUTLIER 70.97 -61.92 0.47 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.822 0.849 . . . . 0.0 111.539 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG23 ' HG2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -96.59 174.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.071 176.313 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.13 52.37 4.62 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.234 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.433 ' HG2' HG23 ' A' ' 43' ' ' VAL . 1.8 ptp180 -91.52 -69.47 0.74 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.31 131.11 36.08 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -139.93 123.73 17.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.222 0.534 . . . . 0.0 110.981 -177.164 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.479 ' CE2' ' HB3' ' A' ' 94' ' ' GLU . 21.9 m-85 -100.28 154.82 18.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.371 176.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.562 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.825 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 60' ' ' TYR . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.611 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.887 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.611 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -71.99 -31.51 66.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.81 HD21 ' HA3' ' A' ' 73' ' ' GLY . 6.9 tp -64.9 -16.46 63.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.62 -178.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.31 -25.15 64.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.108 0.48 . . . . 0.0 110.592 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.4 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -117.3 -46.37 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.672 -177.286 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.29 3.59 58.18 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.959 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.552 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -134.23 42.79 1.32 Allowed Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.91 42.41 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.43 -34.79 90.91 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.62 -28.67 8.79 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.425 173.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 72' ' ' SER . 0.2 OUTLIER -124.45 164.01 20.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.548 0.689 . . . . 0.0 111.675 -176.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mtt -78.99 -22.57 45.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.444 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.14 -36.81 72.1 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 69' ' ' HIS . 11.9 m -142.37 103.39 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.763 0.316 . . . . 0.0 110.53 178.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.81 ' HA3' HD21 ' A' ' 61' ' ' LEU . . . -73.14 -29.01 65.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.241 -0.981 . . . . 0.0 111.903 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.79 25.26 65.21 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.604 176.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 82' ' ' PRO . 6.2 t70 -78.37 95.83 5.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -127.95 110.68 22.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.489 0.662 . . . . 0.0 110.955 -175.196 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 mtt -80.86 103.57 10.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.972 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.439 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 2.0 t 53.96 -108.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 -176.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.439 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -129.52 33.49 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.153 0.501 . . . . 0.0 110.208 177.772 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.42 -2.08 87.16 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 113.139 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 4.2 mt-10 58.31 96.84 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 122.839 0.455 . . . . 0.0 111.635 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.554 ' HB3' ' O ' ' A' ' 75' ' ' ASP . 18.8 Cg_endo -63.32 162.17 28.0 Favored 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 122.986 2.457 . . . . 0.0 113.445 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.81 71.1 6.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.401 175.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -67.99 99.29 0.84 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.974 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.72 34.58 3.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.355 -178.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.64 59.89 2.42 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.332 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 83.63 -42.92 3.09 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.87 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.24 81.82 8.26 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.89 0.376 . . . . 0.0 111.902 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -175.7 5.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.384 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -176.13 102.45 0.17 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 4.2 p-10 -67.56 -92.45 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -171.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.491 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -159.02 -34.6 0.06 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.069 0.461 . . . . 0.0 110.476 -176.416 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 95' ' ' ARG . 7.0 t0 -87.99 14.91 8.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.468 -176.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.479 ' HB3' ' CE2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -79.94 32.86 0.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.638 0.732 . . . . 0.0 110.987 176.625 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.508 ' H ' ' HG3' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -110.14 -138.09 0.37 Allowed 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.135 -177.851 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER 56.74 55.04 6.63 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 171.385 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.581 HG22 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.6 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.629 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t -124.41 -127.44 0.25 Allowed 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -112.53 63.51 0.63 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.498 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -85.48 70.92 10.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.14 -178.188 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -90.98 -81.92 0.3 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.033 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.527 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . 57.03 35.28 26.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.156 -178.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -78.83 125.65 29.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.543 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -66.97 -16.92 64.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.217 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.99 -40.71 58.62 Favored Glycine 0 C--N 1.335 0.475 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 176.037 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.407 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 0.4 OUTLIER -109.34 -89.9 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.198 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.407 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 2.7 t0 -173.95 174.68 2.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.997 171.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.527 ' HA ' ' HA ' ' A' ' 107' ' ' ALA . 1.5 t70 -81.88 114.21 20.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.892 0.377 . . . . 0.0 110.276 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.071 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.33 167.55 11.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.849 0.357 . . . . 0.0 110.637 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.431 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -100.97 -173.91 2.49 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 176.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.428 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.887 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.887 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 3' ' ' LEU . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' CD2' ' A' ' 27' ' ' HIS . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.591 ' O ' HD22 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.591 HD22 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.015 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.822 HG12 HD13 ' A' ' 47' ' ' LEU . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.473 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 1.015 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.71 HD23 HD11 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.611 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.925 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 59' ' ' ASP . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.925 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.04 10.75 51.36 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.538 ' CB ' ' HB2' ' A' ' 32' ' ' SER . 2.0 m -81.54 -75.3 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.885 0.343 . . . . 0.0 111.46 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.458 ' HB3' ' H ' ' A' ' 40' ' ' LEU . 15.5 ttm-85 -159.37 -99.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.12 178.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.821 HD23 ' HB3' ' A' ' 54' ' ' LYS . 1.2 mp 32.85 84.36 0.02 OUTLIER 'General case' 0 C--N 1.346 0.427 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.87 -98.26 0.78 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.399 -0.905 . . . . 0.0 111.964 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.43 ' OE1' ' HH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER 4.19 -98.52 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.673 1.589 . . . . 0.0 114.758 177.767 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.603 HG22 ' H ' ' A' ' 44' ' ' GLY . 2.9 p -152.62 176.54 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.725 0.298 . . . . 0.0 111.563 -174.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.603 ' H ' HG22 ' A' ' 43' ' ' VAL . . . -170.25 -173.2 37.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.227 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -148.97 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.844 0.322 . . . . 0.0 111.055 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 84.63 3.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.822 HD13 HG12 ' A' ' 22' ' ' ILE . 0.6 OUTLIER 176.95 142.83 0.08 Allowed 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -80.96 96.38 7.07 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 1.017 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.482 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 1.017 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.503 HD22 ' HB2' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 62' ' ' ARG . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -70.01 -33.88 72.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.714 HD13 ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -66.01 -19.3 65.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.96 178.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' NH2' ' HA ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -66.95 -27.96 67.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 178.03 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -118.45 -60.17 1.81 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -176.524 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.06 22.19 30.38 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.963 -0.637 . . . . 0.0 113.058 -177.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.714 ' HA3' HD13 ' A' ' 61' ' ' LEU . . . -104.63 -107.56 3.22 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.816 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.93 -102.66 0.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.811 0.338 . . . . 0.0 110.741 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -100.23 -19.14 19.73 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.954 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 62' ' ' ARG . . . 125.29 -15.59 7.24 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -61.9 -177.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.331 0.586 . . . . 0.0 111.75 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.664 ' HA ' ' NH2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.49 -74.84 0.45 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.482 178.588 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.481 ' HA3' ' HA3' ' A' ' 86' ' ' GLY . . . 69.14 -59.5 0.57 Allowed Glycine 0 CA--C 1.523 0.546 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.016 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.649 ' N ' ' H ' ' A' ' 87' ' ' GLY . 1.4 m 61.34 96.38 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.591 0.756 . . . . 0.0 112.287 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.891 ' HA3' ' H ' ' A' ' 85' ' ' MET . . . 146.11 -93.69 0.16 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.574 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 1.002 ' HA2' ' HG2' ' A' ' 88' ' ' GLU . . . 170.42 -137.82 4.65 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -177.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -82.68 141.7 32.25 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 174.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -78.52 94.9 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.069 0.461 . . . . 0.0 110.702 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.14 173.79 7.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.702 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.476 HG23 HG22 ' A' ' 79' ' ' VAL . 35.0 m -70.93 -18.94 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.148 0.499 . . . . 0.0 110.183 175.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.476 HG22 HG23 ' A' ' 78' ' ' VAL . 0.0 OUTLIER -113.82 25.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.716 175.417 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.5 ' HA2' HD12 ' A' ' 84' ' ' LEU . . . -66.93 -52.5 32.7 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.26 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.756 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 65.7 mm-40 61.93 174.62 0.06 OUTLIER Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 122.52 0.328 . . . . 0.0 111.07 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.756 ' HD2' ' HB3' ' A' ' 81' ' ' GLU . 15.5 Cg_exo -40.44 -54.32 2.31 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 123.347 2.698 . . . . 0.0 113.828 -177.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.37 -47.11 18.77 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.043 -0.98 . . . . 0.0 113.099 -177.004 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.684 ' HA ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 mt -102.16 102.82 13.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.803 0.335 . . . . 0.0 111.899 -175.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.891 ' H ' ' HA3' ' A' ' 73' ' ' GLY . 12.0 ttp -126.19 -46.18 1.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.889 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.481 ' HA3' ' HA3' ' A' ' 71' ' ' GLY . . . -148.79 -80.53 0.03 OUTLIER Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.354 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.649 ' H ' ' N ' ' A' ' 72' ' ' SER . . . -56.65 107.57 0.95 Allowed Glycine 0 C--O 1.223 -0.548 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 -175.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 1.002 ' HG2' ' HA2' ' A' ' 74' ' ' GLY . 0.9 OUTLIER -72.22 109.61 6.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -171.114 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -106.26 159.7 15.92 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 169.405 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 178.47 57.79 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.088 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.98 -87.87 0.59 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.215 0.531 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 93' ' ' ASP . 1.1 pt-20 -137.76 -75.37 0.4 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.278 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.775 ' HB3' ' HB3' ' A' ' 96' ' ' LEU . 2.4 t0 -140.99 26.24 2.05 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.571 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.426 ' HG3' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 36.81 -108.32 0.05 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.261 1.024 . . . . 0.0 111.7 -176.213 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.526 HH21 ' HA ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -90.57 81.49 5.9 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 173.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.775 ' HB3' ' HB3' ' A' ' 93' ' ' ASP . 0.2 OUTLIER -75.21 113.3 12.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.465 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m -61.4 -51.09 70.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -82.66 54.15 2.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.375 -0.829 . . . . 0.0 109.891 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.631 ' CD1' ' HB2' ' A' ' 16' ' ' ARG . 9.8 t80 -58.37 -63.94 1.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.429 -177.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.978 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 33.3 t70 48.74 -83.59 0.01 OUTLIER 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.537 1.135 . . . . 0.0 112.413 176.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 66.09 29.43 9.94 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.713 -1.585 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -123.07 -48.72 1.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.803 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -98.7 -36.01 9.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.336 173.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.1 -117.89 1.3 Allowed Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.407 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.409 ' H ' HG13 ' A' ' 111' ' ' ILE . 0.9 OUTLIER -83.05 1.83 3.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 0.0 110.196 176.635 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -94.15 78.42 4.02 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.25 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.978 ' HA ' ' HB2' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -55.42 139.42 43.43 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.695 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.269 178.774 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.615 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.25 159.02 18.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.608 0.204 . . . . 0.0 110.705 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.13 -109.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.761 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.483 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.862 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.627 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.761 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.534 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.915 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.948 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.552 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.436 ' H ' ' H ' ' A' ' 24' ' ' GLN . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.436 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.948 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 39' ' ' ARG . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 1.041 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.692 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.755 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.15 59.18 5.16 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.06 -83.23 0.15 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.48 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.8 OUTLIER -178.14 114.46 0.08 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.497 177.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' ' NH2' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -116.21 74.51 0.9 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.861 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.52 45.69 1.13 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.196 -173.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' OE2' ' HB3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -95.88 -157.87 0.61 Allowed 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.332 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -127.26 7.29 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.261 177.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.23 79.69 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.857 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.561 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -158.31 -93.76 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.171 0.485 . . . . 0.0 110.451 178.601 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.496 ' HG3' ' CG ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -103.34 69.11 0.99 Allowed 'General case' 0 C--N 1.321 -0.669 0 O-C-N 122.188 -0.32 . . . . 0.0 110.874 -179.708 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.773 ' HG ' HG12 ' A' ' 97' ' ' ILE . 1.1 tm? -117.89 117.02 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.035 0.445 . . . . 0.0 110.055 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.717 ' HE1' ' HA ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -138.68 161.57 36.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HB2' HD22 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.862 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.041 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.479 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.459 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.755 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -73.88 -40.15 63.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.834 HD12 ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -73.05 -20.06 61.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 178.648 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.554 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.54 -30.7 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.215 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -121.68 -47.96 2.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.54 -178.312 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.35 20.35 46.89 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.535 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.834 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -122.32 -89.17 0.96 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.78 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -90.2 -121.06 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 176.322 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.491 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -123.79 -54.79 0.19 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.347 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -148.86 -6.24 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.539 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -79.07 -145.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.239 0.542 . . . . 0.0 111.398 -178.475 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.47 -66.64 0.89 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.183 -176.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.522 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . 112.92 -39.52 2.83 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -174.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.514 ' HA ' ' CZ ' ' A' ' 89' ' ' PHE . 51.7 m -70.29 104.41 2.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.09 128.58 9.13 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.558 -174.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 -74.03 0.51 Allowed Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -147.28 160.55 42.37 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 173.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.87 149.67 4.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.774 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 40.2 mtp -67.56 97.87 0.63 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.9 0.381 . . . . 0.0 110.719 -176.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.3 p -123.2 -17.93 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.352 -178.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -104.29 13.78 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.403 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.453 ' HA2' ' HD3' ' A' ' 45' ' ' ARG . . . 84.45 -57.62 5.02 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.34 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.36 87.76 52.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.774 ' HG3' ' HA ' ' A' ' 77' ' ' MET . 92.3 Cg_endo -95.74 -161.44 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.339 2.692 . . . . 0.0 111.571 178.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 140.45 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.602 HD22 ' CD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -111.66 102.4 10.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.543 -175.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.82 7.94 44.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.437 0.637 . . . . 0.0 110.65 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -138.91 -96.69 0.36 Allowed Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.634 ' HA3' HD21 ' A' ' 61' ' ' LEU . . . -72.54 121.48 8.07 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.404 173.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -84.88 84.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 122.413 -0.463 . . . . 0.0 109.905 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.602 ' CD2' HD22 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -69.72 153.79 42.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.136 -174.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 93' ' ' ASP . . . -127.38 87.74 0.33 Allowed Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.717 ' HA ' ' HE1' ' A' ' 48' ' ' TYR . 11.6 p-10 -58.76 -63.06 1.43 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.297 0.57 . . . . 0.0 111.286 -176.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.97 -24.47 43.83 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.22 178.192 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.488 ' HB3' ' HA3' ' A' ' 90' ' ' GLY . 20.9 t70 -67.7 -27.49 66.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.904 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -78.56 -102.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.412 ' HB3' ' CD1' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.0 160.99 36.93 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.025 0.44 . . . . 0.0 110.936 -176.413 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.36 -176.09 3.22 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.915 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.695 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.652 ' HB3' ' HZ ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m -109.21 -121.94 0.26 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -139.84 84.79 2.0 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.652 ' HZ ' ' HB3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -53.41 -83.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.171 -175.221 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -110.3 -70.94 0.78 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.95 0.405 . . . . 0.0 110.059 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.11 -35.54 8.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.405 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.99 -69.48 0.1 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.025 0.828 . . . . 0.0 112.045 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -93.33 3.42 55.64 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.169 0.509 . . . . 0.0 110.346 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.44 167.3 20.1 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.867 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -87.52 -27.89 5.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.017 0.437 . . . . 0.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -88.95 56.91 3.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.657 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -89.2 116.61 27.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.906 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.495 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.469 ' HA2' ' HA3' ' A' ' 14' ' ' GLY . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 m -85.18 178.37 7.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.718 0.259 . . . . 0.0 110.684 178.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -25.96 67.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -175.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.401 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.417 HD12 ' HB2' ' A' ' 4' ' ' LEU . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA2' ' A' ' 1' ' ' GLY . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.883 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.616 HD22 ' HB ' ' A' ' 97' ' ' ILE . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.773 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.462 ' H ' ' H ' ' A' ' 24' ' ' GLN . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.773 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.749 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.02 -33.21 5.19 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.556 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -70.23 -73.77 0.16 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.761 0.315 . . . . 0.0 110.445 -179.702 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HD3' ' O ' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -158.9 -146.79 0.15 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.517 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.812 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 53.0 mt -96.67 111.62 23.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 175.507 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.84 -43.23 5.48 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.688 -174.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.967 ' HG3' ' HG2' ' A' ' 58' ' ' ARG . 10.7 mm-40 -106.33 11.75 30.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.648 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 40' ' ' LEU . 81.5 t -117.84 96.2 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.788 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.78 7.01 25.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.402 -177.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.79 -33.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.502 0.321 . . . . 0.0 110.5 174.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -106.84 122.44 46.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.503 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -95.81 113.88 25.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -178.549 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -107.05 91.4 3.64 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.544 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.851 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.771 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.723 ' HB3' ' HB2' ' A' ' 42' ' ' GLU . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.967 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -66.59 -39.52 88.46 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.516 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.9 OUTLIER -78.54 0.02 27.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.578 177.963 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.59 -21.76 23.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.063 0.458 . . . . 0.0 110.544 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.96 -51.2 2.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.612 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.32 37.9 3.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.471 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -140.93 43.32 1.12 Allowed Glycine 0 N--CA 1.444 -0.777 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 -176.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.42 41.29 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.26 -34.67 2.08 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.61 5.7 88.2 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.329 -0.463 . . . . 0.0 112.965 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.454 ' HB3' ' H ' ' A' ' 70' ' ' MET . 8.6 m170 -120.53 -159.84 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 122.79 -0.241 . . . . 0.0 110.385 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.454 ' H ' ' HB3' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -62.72 -45.52 92.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.661 179.269 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.52 ' HA2' HD22 ' A' ' 84' ' ' LEU . . . 115.81 8.87 13.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.164 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 80.07 0.88 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.263 0.554 . . . . 0.0 110.652 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.47 172.33 38.87 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.607 -174.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 153.11 -30.74 0.8 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -74.73 156.47 36.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.026 175.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.28 113.5 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.827 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.404 ' H ' ' HG3' ' A' ' 77' ' ' MET . 0.3 OUTLIER -77.31 99.25 5.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.568 -176.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -79.96 1.48 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -13.29 10.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.984 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.27 -53.26 4.82 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.867 -0.683 . . . . 0.0 111.948 -178.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.9 mm-40 -72.33 141.62 83.53 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-O 120.517 0.199 . . . . 0.0 110.488 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 88.6 Cg_exo -52.24 -64.79 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.285 2.657 . . . . 0.0 112.936 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 84' ' ' LEU . 0.3 OUTLIER 58.35 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.249 178.056 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.52 HD22 ' HA2' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -80.46 98.78 7.69 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.99 0.424 . . . . 0.0 110.306 179.495 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.39 34.9 1.54 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.098 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 66.2 77.71 0.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.586 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.91 -71.02 2.92 Favored Glycine 0 C--O 1.221 -0.675 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.949 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.93 79.59 9.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 117.07 0.435 . . . . 0.0 111.093 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -84.97 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.749 0.785 . . . . 0.0 109.741 177.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.83 41.8 1.46 Allowed Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.837 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -76.95 0.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.109 0.48 . . . . 0.0 110.437 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -65.32 -18.29 65.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.841 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -101.02 21.81 13.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.452 178.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.05 162.41 16.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.584 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.448 ' HB3' ' HE1' ' A' ' 49' ' ' TYR . 3.8 ttm105 -80.75 93.06 6.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.3 mt -79.02 156.34 28.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.072 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.616 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.41 ' O ' HD23 ' A' ' 19' ' ' LEU . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.883 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.49 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -96.85 0.44 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -174.49 96.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.083 -0.962 . . . . 0.0 108.615 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.467 ' HB3' ' H ' ' A' ' 106' ' ' ASP . 1.8 t80 -157.7 -84.6 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 26.6 t0 24.86 -86.7 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.171 1.788 . . . . 0.0 113.475 -175.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.977 ' HB1' ' HB ' ' A' ' 111' ' ' ILE . . . -159.76 35.04 0.19 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.363 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.601 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . -65.45 -8.16 17.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.503 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -64.87 -25.58 67.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.195 177.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 152.9 -21.94 0.79 Allowed Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.357 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.977 ' HB ' ' HB1' ' A' ' 107' ' ' ALA . 19.0 mm -68.07 -37.35 78.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 0.0 110.854 -179.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.95 69.51 0.19 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.49 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.601 ' HA ' ' HA ' ' A' ' 108' ' ' ALA . 0.5 OUTLIER -82.6 115.8 21.73 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.487 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.596 -177.407 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -112.67 -125.89 0.28 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.31 174.95 7.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.424 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.9 OUTLIER 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.519 HG23 ' NE2' ' A' ' 27' ' ' HIS . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.629 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.656 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.982 HD22 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.435 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.938 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 40' ' ' LEU . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 56' ' ' CYS . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.72 45.53 88.42 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.59 -81.96 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.715 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -152.53 -162.16 1.45 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 31' ' ' LEU . 10.7 mt -119.47 144.54 46.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.829 0.347 . . . . 0.0 110.326 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.66 42.96 2.23 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.168 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' HB3' ' C ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -74.83 126.96 32.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.792 -0.204 . . . . 0.0 110.812 -178.399 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -143.71 4.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 177.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.41 10.05 0.07 OUTLIER Glycine 0 CA--C 1.528 0.887 0 C-N-CA 118.559 -1.782 . . . . 0.0 116.183 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.491 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 6.8 ttm180 -109.41 -98.58 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 119.499 1.649 . . . . 0.0 112.49 -173.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 45' ' ' ARG . 2.6 ptm180 -148.19 154.96 40.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.943 -173.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.883 HD12 ' HG2' ' A' ' 95' ' ' ARG . 0.9 OUTLIER -69.65 108.54 3.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.623 -178.422 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.464 ' H ' ' HG3' ' A' ' 95' ' ' ARG . 3.8 m-85 -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.951 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.523 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.523 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.566 ' HA ' ' NH2' ' A' ' 95' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.651 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.777 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.651 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER -72.61 -33.56 66.76 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -69.61 0.52 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.037 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 -79.39 0.09 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.103 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.33 -35.36 2.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.777 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -140.52 -60.78 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.86 176.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' ' H ' ' A' ' 88' ' ' GLU . . . -144.81 41.43 1.08 Allowed Glycine 0 C--O 1.226 -0.369 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.764 -178.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 m 28.96 42.82 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.898 1.074 . . . . 0.0 113.898 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -117.48 -70.86 0.41 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.86 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.79 -4.9 57.97 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.336 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.32 159.91 14.7 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -51.64 52.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -86.6 102.89 2.77 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.848 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.482 ' CB ' ' HB2' ' A' ' 88' ' ' GLU . 0.6 OUTLIER -89.6 -163.8 1.06 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.634 0.254 . . . . 0.0 110.863 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.686 ' HA3' HD13 ' A' ' 84' ' ' LEU . . . -83.55 -87.51 0.81 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.667 -178.354 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.17 -143.58 25.2 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.372 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -101.4 95.96 6.84 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.558 0.694 . . . . 0.0 110.432 -179.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.46 175.11 10.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.887 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.5 mtt -56.23 135.55 53.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.942 0.401 . . . . 0.0 111.523 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.683 HG21 ' HA ' ' A' ' 82' ' ' PRO . 14.8 p -155.68 145.82 12.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.172 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.73 -42.65 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.952 0.406 . . . . 0.0 111.175 -177.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -156.53 -99.24 0.16 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.908 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -66.14 123.96 86.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.186 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.683 ' HA ' HG21 ' A' ' 78' ' ' VAL . 11.7 Cg_exo -69.33 144.95 58.1 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.212 1.941 . . . . 0.0 111.962 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -167.92 119.05 0.83 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.165 -178.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.686 HD13 ' HA3' ' A' ' 73' ' ' GLY . 1.3 mt -120.37 149.37 42.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.429 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.16 1.19 15.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.984 0.421 . . . . 0.0 110.635 -178.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -87.52 -99.48 0.88 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.914 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -135.31 -177.28 14.85 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-O 119.116 -0.824 . . . . 0.0 111.798 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' H ' ' HA3' ' A' ' 65' ' ' GLY . 1.8 mp0 12.24 78.49 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.22 1.408 . . . . 0.0 113.702 176.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.485 ' HD1' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-85 -72.71 -82.78 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.533 -173.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.432 ' H ' ' HB2' ' A' ' 89' ' ' PHE . . . -153.87 98.41 0.18 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.26 -82.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.958 -0.121 . . . . 0.0 111.039 -175.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 94' ' ' GLU . 2.4 mp0 70.64 109.18 0.06 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.641 -168.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.463 ' CG ' HH12 ' A' ' 95' ' ' ARG . 28.0 t70 -70.08 38.06 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.028 -1.442 . . . . 0.0 112.175 -174.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 92' ' ' GLU . 3.7 mm-40 -61.25 154.26 24.05 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.856 -176.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.883 ' HG2' HD12 ' A' ' 47' ' ' LEU . 2.3 ttm105 -166.85 -167.49 0.97 Allowed 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.692 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.78 155.18 44.07 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.982 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.472 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -123.77 -86.42 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.472 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -125.94 -63.6 1.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.309 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.431 ' HD1' ' HA ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -157.85 -121.37 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.911 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' HB3' ' OD2' ' A' ' 113' ' ' ASP . 17.8 t0 -154.56 -81.06 0.08 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.628 ' HB3' ' OD1' ' A' ' 113' ' ' ASP . . . -119.81 -78.21 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.297 171.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -166.54 -15.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ASN . . . . . 0.679 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . 30.8 t30 -82.68 -29.94 29.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.87 -122.69 6.86 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.014 178.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 10.6 mt -58.5 -58.14 7.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.982 0.42 . . . . 0.0 111.235 -176.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -93.21 66.71 4.08 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.45 174.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.679 ' HA ' ' HB3' ' A' ' 109' ' ' ASN . 1.3 t0 -78.31 165.76 23.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.879 -176.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.209 -178.349 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.968 -0.453 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.95 128.78 37.92 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.702 0.286 . . . . 0.0 110.75 -178.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt -79.06 174.16 11.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.74 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.74 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HB3' ' CD1' ' A' ' 105' ' ' PHE . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.485 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.504 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.967 HD11 ' HA2' ' A' ' 41' ' ' GLY . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.9 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.8 pm0 -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.9 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.84 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.673 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.746 HD21 HD21 ' A' ' 63' ' ' LEU . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.673 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.28 21.46 6.58 Favored Glycine 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.64 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -83.92 -101.99 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.271 0.535 . . . . 0.0 110.507 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.54 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -178.47 155.54 0.87 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 117.907 0.321 . . . . 0.0 111.037 179.708 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.466 HD13 HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.91 164.87 27.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.837 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.967 ' HA2' HD11 ' A' ' 19' ' ' LEU . . . 168.8 48.48 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.754 -178.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' OE2' ' HD3' ' A' ' 46' ' ' ARG . 1.3 pm0 -139.85 -179.92 6.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 -178.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.711 ' HB ' ' H ' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -124.55 121.23 61.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 176.164 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 163.19 -167.9 37.7 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.116 -174.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.631 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -80.89 44.71 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.461 0.648 . . . . 0.0 110.784 177.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.49 ' HD3' ' OE2' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -93.38 -168.18 1.86 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.941 178.397 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.466 HD22 HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -22.26 118.78 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.53 ' CB ' ' HA ' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -109.54 131.25 55.24 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.667 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 1.056 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.5 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.467 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 1.056 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.648 ' HG2' HG23 ' A' ' 83' ' ' THR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.61 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -63.22 -37.02 85.61 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.443 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -66.03 -9.75 33.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.2 -176.751 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.71 -20.52 58.3 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.802 175.741 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.746 HD21 HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -116.83 -42.66 2.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.799 176.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.17 23.13 10.06 Favored Glycine 0 C--N 1.329 0.16 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -100.22 45.26 1.5 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.008 -0.596 . . . . 0.0 111.696 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -21.47 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -173.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.467 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -70.89 -10.77 68.61 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.678 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.76 -120.11 5.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.604 -0.331 . . . . 0.0 112.645 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -39.0 13.16 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.2 mtt -62.14 -57.27 12.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.45 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.467 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 60.51 45.89 95.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.21 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -107.45 54.78 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.047 0.451 . . . . 0.0 110.227 -178.774 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.635 ' H ' ' HE1' ' A' ' 89' ' ' PHE . . . -75.55 -50.58 7.99 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.957 -175.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.87 -70.57 2.71 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.651 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -135.59 106.54 6.65 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 175.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -112.31 113.96 45.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.283 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.8 mtp -71.36 98.06 1.71 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.406 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -168.22 -162.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.445 177.059 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.406 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 3.1 t -109.61 38.98 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 172.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.81 -72.08 1.27 Allowed Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.419 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 1.9 mt-10 62.28 79.58 0.27 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.422 ' HA ' ' HE1' ' A' ' 60' ' ' TYR . 4.4 Cg_endo -92.62 162.09 2.87 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.231 2.621 . . . . 0.0 113.388 -175.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.648 HG23 ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -77.51 165.76 23.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mp -66.65 99.0 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.03 -47.94 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.712 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -135.96 -78.23 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.024 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 72' ' ' SER . . . -81.53 48.07 3.76 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.369 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 20.71 81.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.25 0 C-N-CA 125.285 1.434 . . . . 0.0 114.614 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.635 ' HE1' ' H ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -86.72 -151.62 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.84 175.539 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -179.96 108.16 0.23 Allowed Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' A' ' 92' ' ' GLU . 23.0 p-10 -70.89 -59.25 2.9 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.861 0.362 . . . . 0.0 110.415 -177.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.521 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 4.7 mt-10 77.32 -5.53 2.14 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.796 -176.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.461 ' OD2' ' HG ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -84.4 22.38 1.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.844 171.415 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.53 ' HA ' ' CB ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -78.84 61.95 3.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.093 -0.958 . . . . 0.0 112.045 -171.457 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.596 ' HB3' ' HD1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -89.17 86.12 6.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.013 0.435 . . . . 0.0 109.872 173.546 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 45' ' ' ARG . 3.1 pp -78.52 174.2 11.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.353 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.75 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.711 ' H ' ' HB ' ' A' ' 43' ' ' VAL . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.479 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' H ' ' A' ' 103' ' ' THR . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.436 HG22 ' HG3' ' A' ' 104' ' ' GLN . 1.8 m -144.66 -123.83 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.436 ' HG3' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -94.23 40.91 1.08 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.184 0.516 . . . . 0.0 110.129 176.236 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.477 ' CD1' ' HB3' ' A' ' 16' ' ' ARG . 7.5 t80 -78.81 -70.22 0.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.209 -177.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 107' ' ' ALA . 23.8 t0 -53.64 -77.81 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.288 0.566 . . . . 0.0 110.492 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.406 ' H ' ' HB3' ' A' ' 106' ' ' ASP . . . -167.89 36.78 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.424 174.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 112' ' ' ASP . . . -100.59 124.35 46.04 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.842 -176.209 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -124.84 22.87 8.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.161 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.96 -49.53 0.86 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.058 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.7 50.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 108' ' ' ALA . 1.5 t70 61.49 -160.01 0.31 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.845 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.28 95.58 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.321 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.77 154.08 39.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.743 0.306 . . . . 0.0 110.723 179.43 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.83 170.41 16.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.431 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.571 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.6 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.524 ' NE2' ' HE1' ' A' ' 27' ' ' HIS . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.536 HD12 ' HG ' ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.688 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.611 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.829 HD22 ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.852 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.852 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.406 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 6.6 m80 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.533 HD22 HD11 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.64 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.778 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.13 -11.56 62.54 Favored Glycine 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -81.98 0.14 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.783 -0.245 . . . . 0.0 110.83 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.485 ' HD2' ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -133.52 177.15 7.92 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 177.158 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.647 HD13 ' HG2' ' A' ' 95' ' ' ARG . 13.3 mt -93.05 -37.68 12.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 -175.703 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.51 -42.3 1.21 Allowed Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 97' ' ' ILE . 1.3 mp0 57.22 27.91 14.32 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 122.992 0.517 . . . . 0.0 112.321 173.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.33 99.16 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.436 0.636 . . . . 0.0 110.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 172.9 26.66 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.865 -177.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.85 3.34 18.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.989 0.424 . . . . 0.0 110.918 -179.186 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CD ' ' HG3' ' A' ' 92' ' ' GLU . 4.3 mtp85 -129.68 170.51 13.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.281 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.717 ' HG ' ' HG3' ' A' ' 95' ' ' ARG . 6.0 tt -140.69 121.61 14.53 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -126.17 144.78 50.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.068 -175.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.696 ' HB2' HD22 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.681 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.696 HD22 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.872 ' HB3' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.519 ' HD3' ' OE1' ' A' ' 94' ' ' GLU . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -79.31 -39.79 31.98 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.582 HD12 ' HA2' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -69.77 -57.89 4.56 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.919 177.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HB3' ' H ' ' A' ' 63' ' ' LEU . 5.4 tpp180 -162.93 -99.29 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.038 175.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.731 HD13 ' H ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -106.34 -50.42 3.15 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 176.068 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.644 ' N ' HD22 ' A' ' 63' ' ' LEU . . . -126.59 7.14 7.46 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.689 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.582 ' HA2' HD12 ' A' ' 61' ' ' LEU . . . 25.91 43.71 0.02 OUTLIER Glycine 0 N--CA 1.468 0.812 0 N-CA-C 116.178 1.231 . . . . 0.0 116.178 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -45.79 51.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.017 0.437 . . . . 0.0 110.895 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.433 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -139.36 -19.88 0.44 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.518 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.63 -69.43 3.36 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.379 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.36 -58.48 0.69 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.013 0.435 . . . . 0.0 110.31 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 44.7 mtm -76.45 -70.58 0.44 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.711 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.433 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 156.27 -60.15 0.36 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.981 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.77 65.27 0.77 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.031 0.443 . . . . 0.0 110.054 178.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.414 ' HA3' ' HE1' ' A' ' 89' ' ' PHE . . . -58.74 109.5 2.06 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.571 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -164.03 -111.83 0.26 Allowed Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -83.66 93.58 7.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.049 0.452 . . . . 0.0 109.925 173.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.446 ' HB ' HG13 ' A' ' 79' ' ' VAL . 1.9 t -137.49 162.88 32.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.85 -177.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.3 mtm -54.95 109.54 0.53 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.2 t 50.55 76.26 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.839 0.712 . . . . 0.0 111.808 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.446 HG13 ' HB ' ' A' ' 76' ' ' VAL . 0.0 OUTLIER -101.63 -20.82 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.488 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.45 2.03 90.55 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -173.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.773 ' HA ' HD21 ' A' ' 84' ' ' LEU . 5.5 mp0 46.15 69.77 2.43 Favored Pre-proline 0 C--O 1.232 0.168 0 C-N-CA 123.759 0.824 . . . . 0.0 111.763 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HB2' ' H ' ' A' ' 83' ' ' THR . 59.6 Cg_endo -88.46 -128.39 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.243 2.628 . . . . 0.0 111.206 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -78.12 77.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.501 176.437 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 81' ' ' GLU . 0.2 OUTLIER -74.23 98.64 3.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 110.53 -175.941 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -136.94 24.41 3.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 65.79 55.94 17.26 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.804 -0.712 . . . . 0.0 113.095 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.03 -58.3 4.77 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.365 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.478 ' CD ' HH22 ' A' ' 58' ' ' ARG . 1.1 mt-10 -87.16 67.67 9.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.613 0.244 . . . . 0.0 110.945 -177.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.505 ' HB3' ' HB ' ' A' ' 83' ' ' THR . 0.0 OUTLIER -75.99 139.49 41.54 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 110.938 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.72 ' HA3' ' HD2' ' A' ' 57' ' ' ARG . . . 174.97 -101.25 0.16 Allowed Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.433 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.611 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 11.1 p-10 -105.83 -102.92 0.33 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.914 -0.643 . . . . 0.0 110.677 -178.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.611 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.5 OUTLIER -142.65 -52.66 0.39 Allowed 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 122.347 -0.221 . . . . 0.0 111.098 178.437 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.465 ' C ' ' HG2' ' A' ' 94' ' ' GLU . 0.2 OUTLIER -140.81 26.16 2.1 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.624 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.872 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER 41.33 -108.34 0.09 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.803 1.241 . . . . 0.0 114.086 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.717 ' HG3' ' HG ' ' A' ' 47' ' ' LEU . 0.5 OUTLIER -132.29 125.61 31.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -167.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.518 ' O ' HD12 ' A' ' 47' ' ' LEU . 0.1 OUTLIER -122.12 159.89 26.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 171.225 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.829 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.812 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.611 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.688 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t -102.17 -123.59 0.18 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.9 70.67 1.29 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -162.63 101.56 1.04 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.252 -175.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -96.37 -81.99 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.082 0.467 . . . . 0.0 110.139 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.432 ' H ' ' HA ' ' A' ' 113' ' ' ASP . . . 64.07 37.0 9.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.189 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -95.38 -171.74 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.056 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -91.2 22.03 4.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.8 0.333 . . . . 0.0 111.139 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -79.49 -87.13 0.54 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.34 176.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -103.59 -69.53 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -166.01 -108.96 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.136 172.306 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.432 ' HA ' ' H ' ' A' ' 107' ' ' ALA . 15.5 t0 -120.31 97.15 5.45 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.831 -0.604 . . . . 0.0 110.236 -177.721 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.88 122.01 19.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.916 0.388 . . . . 0.0 110.611 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.24 166.58 22.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.56 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.63 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.63 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.56 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 110' ' ' GLY . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.538 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.595 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.877 HD21 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 1.005 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.976 HG12 HD13 ' A' ' 47' ' ' LEU . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 1.005 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.949 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.919 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD12 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.919 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.63 25.05 8.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.466 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -92.06 -104.95 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 117.155 0.477 . . . . 0.0 110.75 178.28 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.949 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.0 OUTLIER -166.5 159.49 14.48 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.109 0.413 . . . . 0.0 111.471 -178.717 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.811 HD13 ' HG3' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -136.37 137.65 40.78 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.567 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 168.36 62.9 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 119.581 -1.295 . . . . 0.0 114.526 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB2' ' O ' ' A' ' 81' ' ' GLU . 5.3 mt-10 -118.84 -82.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.14 0.47 . . . . 0.0 110.367 172.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.632 ' HB ' ' HB2' ' A' ' 77' ' ' MET . 0.0 OUTLIER -137.96 132.66 43.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 120.446 0.165 . . . . 0.0 110.697 177.14 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.559 ' CA ' ' HB3' ' A' ' 77' ' ' MET . . . -156.93 -169.93 21.37 Favored Glycine 0 N--CA 1.461 0.329 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.702 ' HD3' ' OD1' ' A' ' 93' ' ' ASP . 0.0 OUTLIER -137.56 -69.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.03 0.915 . . . . 0.0 111.19 177.352 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 2.6 mtm180 -117.27 -173.64 2.45 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.976 HD13 HG12 ' A' ' 22' ' ' ILE . 0.2 OUTLIER -117.17 149.74 39.87 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -174.521 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.638 ' HE2' ' HB2' ' A' ' 91' ' ' ASP . 6.2 m-85 -116.7 146.12 42.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.935 175.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 1.021 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.543 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 1.021 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.593 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HD3' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.702 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.449 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -73.55 -30.31 62.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.23 -61.74 1.66 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.571 0.701 . . . . 0.0 110.729 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 59' ' ' ASP . 1.0 OUTLIER -145.09 -99.98 0.1 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 178.2 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.573 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.1 OUTLIER -125.87 -36.07 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.241 0.543 . . . . 0.0 109.67 166.576 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -141.6 43.74 1.06 Allowed Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.224 -176.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.05 40.63 0.11 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 -172.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.602 ' OG ' ' HD2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.1 47.09 0.89 Allowed 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 123.32 0.648 . . . . 0.0 110.642 179.245 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.721 ' HA2' ' O ' ' A' ' 87' ' ' GLY . . . 29.37 -98.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.44 0 O-C-N 124.106 0.879 . . . . 0.0 114.911 -169.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.775 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . -171.44 -122.53 0.65 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.647 -1.263 . . . . 0.0 112.878 177.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.402 ' HB3' ' H ' ' A' ' 70' ' ' MET . 4.5 t-80 -136.93 -86.98 0.31 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.88 0.372 . . . . 0.0 111.455 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.402 ' H ' ' HB3' ' A' ' 69' ' ' HIS . 0.7 OUTLIER -90.26 -46.86 8.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.804 -176.318 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.96 35.84 4.78 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.304 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.775 ' HB3' ' HA3' ' A' ' 68' ' ' GLY . 4.7 t -173.23 158.61 3.65 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.04 -169.54 31.17 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.91 179.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 92' ' ' GLU . . . -121.95 -53.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.615 -179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -80.51 158.91 25.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.583 0.23 . . . . 0.0 110.955 -179.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -100.36 93.89 3.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 109.825 176.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.632 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . 40.3 mtm -75.93 160.77 29.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.54 -174.852 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.615 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.99 -36.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -176.39 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 t -69.34 -45.69 78.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -166.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.552 ' H ' ' N ' ' A' ' 44' ' ' GLY . . . 144.54 93.35 0.16 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 119.301 -1.428 . . . . 0.0 114.832 177.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 1.8 pt-20 -157.95 163.54 24.27 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.42 -171.76 0.07 OUTLIER 'Trans proline' 0 N--CA 1.48 0.706 0 C-N-CA 122.664 2.243 . . . . 0.0 112.979 -174.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.505 ' OG1' ' HA2' ' A' ' 68' ' ' GLY . 0.5 OUTLIER -177.06 160.16 1.74 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.174 -0.329 . . . . 0.0 111.339 179.209 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 ' HE2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -105.01 -179.89 4.08 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.014 0.435 . . . . 0.0 110.718 178.041 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 19.6 ttt -91.66 -38.11 12.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.982 174.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -152.99 120.71 1.08 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.335 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.721 ' O ' ' HA2' ' A' ' 67' ' ' GLY . . . 149.19 106.75 0.4 Allowed Glycine 0 C--O 1.222 -0.635 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.75 143.08 27.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.131 0.465 . . . . 0.0 111.107 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.558 ' HD2' ' H ' ' A' ' 67' ' ' GLY . 90.3 m-85 -132.32 -167.55 1.91 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.32 -178.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.79 15.14 12.64 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.747 -173.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.638 ' HB2' ' HE2' ' A' ' 48' ' ' TYR . 1.1 p30 -116.35 -87.12 0.61 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.947 0.374 . . . . 0.0 111.148 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 74' ' ' GLY . 4.2 mt-10 63.83 10.1 4.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.424 0.631 . . . . 0.0 110.644 -177.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.702 ' OD1' ' HD3' ' A' ' 45' ' ' ARG . 14.5 t0 -120.69 35.45 4.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.104 -171.023 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.531 ' CD ' ' HG2' ' A' ' 58' ' ' ARG . 17.1 tt0 -79.21 -47.56 15.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.975 ' HA ' ' HG ' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.47 125.22 23.92 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.805 -1.158 . . . . 0.0 114.074 -168.679 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 47' ' ' LEU . 0.1 OUTLIER -124.41 156.81 36.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.002 172.857 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.877 ' HD2' HD21 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.45 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -140.42 -103.87 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.467 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -161.79 94.29 0.94 Allowed 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.514 ' N ' ' H ' ' A' ' 110' ' ' GLY . 12.4 t80 -35.6 -55.16 0.69 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -168.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 113' ' ' ASP . 0.3 OUTLIER -37.26 -48.79 0.9 Allowed 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.727 0.642 . . . . 0.0 112.149 -175.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -124.74 26.39 7.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.63 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -169.75 -137.74 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.887 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 29.6 t-20 -131.63 45.38 2.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.177 0.513 . . . . 0.0 111.701 -176.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLY . . . . . 0.655 ' O ' ' HB2' ' A' ' 16' ' ' ARG . . . -103.35 -147.48 18.41 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.679 176.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.02 -60.01 2.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 117.292 0.546 . . . . 0.0 110.28 176.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -132.69 -176.51 4.13 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.217 -0.901 . . . . 0.0 108.824 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 106' ' ' ASP . 15.0 t70 -87.68 142.27 27.96 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.724 0.297 . . . . 0.0 110.491 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.969 -0.539 . . . . 0.0 109.723 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.44 140.87 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.721 0.295 . . . . 0.0 110.649 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' HD21 ' A' ' 12' ' ' ASN . 1.2 mt -100.17 -169.91 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.113 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.473 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.645 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.44 HD21 ' HB2' ' A' ' 3' ' ' LEU . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.438 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.545 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.402 ' HD2' ' HE ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.856 HD22 ' HB ' ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.667 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.667 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.875 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.493 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.715 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.819 ' HB3' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.44 22.46 75.55 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -98.03 -109.73 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.526 0.663 . . . . 0.0 110.367 178.567 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.2 168.17 19.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.715 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 72.3 mt -90.53 111.7 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.793 0.33 . . . . 0.0 110.391 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -144.9 -43.63 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.862 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -87.69 55.56 3.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.016 0.436 . . . . 0.0 110.02 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.44 ' HA ' HH22 ' A' ' 58' ' ' ARG . 0.9 OUTLIER -129.74 -175.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.029 -176.831 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.47 -167.44 18.46 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HE ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -71.23 -9.52 58.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 117.372 0.586 . . . . 0.0 110.353 177.198 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.881 ' HB3' HD22 ' A' ' 96' ' ' LEU . 2.0 mtp180 -103.13 -169.67 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.755 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.558 HD13 HD11 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -160.54 176.4 11.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.767 177.812 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 -142.1 144.59 33.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.352 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.569 ' HE1' ' H ' ' A' ' 95' ' ' ARG . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.51 ' HB2' HD23 ' A' ' 55' ' ' LEU . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.529 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.819 HD13 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.457 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.731 ' HA ' ' HD2' ' A' ' 62' ' ' ARG . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -76.7 -36.74 57.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.658 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -78.52 -9.12 59.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.287 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.874 HH21 ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -65.55 -29.13 69.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 178.322 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -36.76 2.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.543 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.91 -7.03 86.2 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.437 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.658 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -121.15 -109.04 2.12 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.514 177.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.36 -72.05 0.37 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.879 0.371 . . . . 0.0 110.48 176.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.81 -72.55 0.32 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.18 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.52 ' HA2' HD22 ' A' ' 84' ' ' LEU . . . 62.1 35.31 91.29 Favored Glycine 0 C--O 1.226 -0.346 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.01 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.874 ' HA ' HH21 ' A' ' 62' ' ' ARG . 1.8 m-70 -100.59 -37.88 8.59 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.97 0.415 . . . . 0.0 110.553 -177.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.42 -25.58 61.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.712 -178.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 84' ' ' LEU . . . -95.08 101.62 2.74 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.519 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 m -155.72 61.19 0.6 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.34 0.591 . . . . 0.0 110.079 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.423 ' H ' ' N ' ' A' ' 87' ' ' GLY . . . 73.83 173.1 27.16 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.688 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 68.68 -124.6 18.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.476 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -122.02 142.65 50.12 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.1 p -109.58 147.57 13.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.657 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.5 mtm -65.51 106.98 1.55 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.05 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -63.23 104.8 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.631 -174.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.531 ' H ' ' HG3' ' A' ' 82' ' ' PRO . 11.8 p -91.22 38.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-O 122.223 1.011 . . . . 0.0 109.933 178.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.89 -60.13 3.52 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.506 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -154.52 83.18 4.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.531 ' HG3' ' H ' ' A' ' 79' ' ' VAL . 4.6 Cg_exo -78.93 148.42 22.06 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.526 2.151 . . . . 0.0 112.762 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -9.21 58.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.624 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.715 ' HB3' ' CD1' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -118.12 99.7 7.05 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.27 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 8.1 ttt -91.78 -42.05 10.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -125.73 -160.41 10.64 Favored Glycine 0 N--CA 1.441 -1.003 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.423 ' N ' ' H ' ' A' ' 73' ' ' GLY . . . -70.79 -39.32 65.75 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.31 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -82.86 55.43 3.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.693 -0.253 . . . . 0.0 111.184 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 84' ' ' LEU . 2.1 m-85 -26.07 -73.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.397 1.079 . . . . 0.0 112.714 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.74 87.16 0.42 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.545 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.401 ' HB2' ' CG ' ' A' ' 94' ' ' GLU . 0.4 OUTLIER -71.1 -99.65 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.522 -0.339 . . . . 0.0 110.396 -176.179 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 67.09 -42.46 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.058 0.943 . . . . 0.0 113.499 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.27 35.24 3.12 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 120.956 0.408 . . . . 0.0 111.252 -173.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.401 ' CG ' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -108.68 138.4 45.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.126 0.489 . . . . 0.0 111.216 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.569 ' H ' ' HE1' ' A' ' 49' ' ' TYR . 2.4 ttt85 -97.25 -2.02 43.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.797 176.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.881 HD22 ' HB3' ' A' ' 46' ' ' ARG . 11.9 mt 59.43 -159.33 0.3 Allowed 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.866 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.856 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.58 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m -43.74 -55.88 4.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -4.73 4.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.433 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -126.01 -135.65 0.26 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 121.965 -0.459 . . . . 0.0 110.142 178.552 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.47 ' O ' ' HB3' ' A' ' 101' ' ' GLU . 11.0 t70 -178.05 -77.37 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.728 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.402 ' H ' ' HB3' ' A' ' 106' ' ' ASP . . . 51.71 33.53 11.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.034 178.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.28 -59.73 0.77 Allowed 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.459 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -137.45 -16.03 1.39 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.811 0.339 . . . . 0.0 111.555 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.45 -166.85 39.25 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.658 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.1 mp -93.12 -13.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.356 0.598 . . . . 0.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.77 65.95 4.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.197 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -108.99 143.49 38.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.307 -176.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.256 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.55 120.13 16.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.734 0.302 . . . . 0.0 110.366 178.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -72.79 170.33 14.86 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.473 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.439 ' HB ' ' OE1' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.688 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.552 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 1.6 pp0? -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.552 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.473 HD12 ' CB ' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.641 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.74 HD22 HD13 ' A' ' 97' ' ' ILE . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.722 HD13 ' HG2' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.414 HD13 ' CD1' ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.793 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 1.035 ' HB2' ' H ' ' A' ' 38' ' ' CYS . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.405 ' HB2' ' NE ' ' A' ' 95' ' ' ARG . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.589 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.531 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 68.21 45.92 67.83 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 1.035 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.38 -89.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 117.134 0.467 . . . . 0.0 110.823 178.083 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.413 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 2.3 tpt180 -158.8 169.06 25.21 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.549 0.214 . . . . 0.0 110.92 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.793 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 79.9 mt -109.1 -85.73 0.53 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.824 0.345 . . . . 0.0 110.712 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 131.22 -34.12 2.67 Favored Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.004 -0.839 . . . . 0.0 111.004 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.502 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.6 OUTLIER 50.26 51.71 16.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.43 0.692 . . . . 0.0 111.873 173.922 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 m -140.85 9.54 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.581 ' HA3' ' HA ' ' A' ' 91' ' ' ASP . . . -78.51 7.34 48.36 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.293 -0.955 . . . . 0.0 111.968 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 44' ' ' GLY . 0.3 OUTLIER 166.96 -85.95 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 176.743 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.502 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -134.38 3.6 3.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.968 -1.469 . . . . 0.0 107.962 158.812 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.841 ' HB3' ' HB2' ' A' ' 96' ' ' LEU . 0.2 OUTLIER 155.92 -171.62 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-N 113.917 -1.492 . . . . 0.0 108.876 174.332 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.854 ' HD2' ' HG3' ' A' ' 94' ' ' GLU . 1.4 t80 -159.05 147.21 17.93 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.839 ' HB3' ' H ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.722 ' HG2' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.871 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.716 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.563 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -78.08 -44.17 27.01 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -56.17 12.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.172 176.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.7 ' HB2' ' HB3' ' A' ' 66' ' ' SER . 10.9 tpp180 -163.71 -80.47 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.702 -1.136 . . . . 0.0 108.04 169.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' H ' ' HB3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -127.62 -29.15 2.67 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.043 168.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.716 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -135.07 -66.04 0.07 OUTLIER Glycine 0 N--CA 1.435 -1.424 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.757 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -145.58 21.55 1.85 Allowed Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.018 -1.087 . . . . 0.0 114.425 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.7 ' HB3' ' HB2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER 26.62 43.95 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -175.758 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -108.78 42.28 1.99 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.306 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.56 -24.29 61.69 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.443 -0.408 . . . . 0.0 112.939 -177.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.64 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.612 0.72 . . . . 0.0 111.258 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 12.7 mtp -68.14 -38.45 82.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.007 -177.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 126.2 -45.79 1.13 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.12 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.85 123.68 29.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.528 0.204 . . . . 0.0 110.513 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.634 ' HA2' ' HA2' ' A' ' 87' ' ' GLY . . . 93.49 -167.38 28.64 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.355 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 145.95 -8.59 1.51 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.105 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -136.81 139.36 41.71 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 117.526 0.663 . . . . 0.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.0 t -77.82 124.88 36.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.101 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG2' ' O ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -70.26 113.63 7.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.137 178.452 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.3 m -117.43 -0.37 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.626 -176.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 1.6 t -110.87 -27.8 2.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.277 0.56 . . . . 0.0 110.42 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.74 24.17 1.57 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.712 -178.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.501 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.9 mp0 -75.25 135.8 72.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 5.3 Cg_exo -80.39 147.97 18.33 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.242 1.961 . . . . 0.0 112.143 -177.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 0.2 OUTLIER -75.21 98.03 3.65 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.161 178.694 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mt -88.59 -179.16 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.914 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -38.49 64.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.92 0.39 . . . . 0.0 110.519 -179.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.14 70.67 0.55 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.893 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.634 ' HA2' ' HA2' ' A' ' 73' ' ' GLY . . . 96.01 158.25 32.02 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.348 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' MET . 3.0 mp0 -83.09 31.41 0.44 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.901 0.381 . . . . 0.0 111.94 -176.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.504 ' CE2' ' HA3' ' A' ' 87' ' ' GLY . 0.0 OUTLIER -122.87 152.53 40.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.299 -177.72 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -138.11 80.49 0.29 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.966 -0.853 . . . . 0.0 110.966 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.581 ' HA ' ' HA3' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -147.75 -85.87 0.1 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.16 -0.52 . . . . 0.0 110.069 -171.9 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.679 ' HA ' ' HG2' ' A' ' 58' ' ' ARG . 1.9 mp0 72.67 -16.03 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.708 0.803 . . . . 0.0 112.502 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 1.9 p30 -115.08 34.27 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -174.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.871 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 0.1 OUTLIER -64.19 101.64 0.43 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -173.355 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HG3' ' HB2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER 179.51 45.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.191 1.396 . . . . 0.0 108.639 176.056 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -70.29 147.21 49.94 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -165.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.74 HD13 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.586 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m -56.88 -65.82 0.55 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 66.0 mm-40 -84.37 54.19 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.213 0.53 . . . . 0.0 111.594 -176.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.558 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 57.3 t80 -126.64 -33.83 2.49 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.285 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -44.83 -33.16 1.82 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.478 -177.59 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.508 ' HA ' ' HB2' ' A' ' 113' ' ' ASP . . . 100.25 51.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 O-C-N 125.24 1.587 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -91.44 -25.58 19.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.194 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -97.1 -20.25 18.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.788 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -174.85 -146.4 5.72 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.122 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -92.27 -39.53 11.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 0.0 109.996 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -108.61 87.25 2.45 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.508 ' HB2' ' HA ' ' A' ' 107' ' ' ALA . 6.2 t0 -53.33 138.73 31.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.396 -1.275 . . . . 0.0 112.788 -169.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.878 -1.058 . . . . 0.0 109.044 178.304 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -165.54 0.84 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.845 0.355 . . . . 0.0 111.108 -179.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt -99.87 -49.37 4.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.716 ' CA ' ' HG2' ' A' ' 46' ' ' ARG . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.61 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.61 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' A' ' 27' ' ' HIS . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HB2' ' HD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.646 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.954 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.579 HD12 ' CD1' ' A' ' 47' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.954 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.543 ' CZ3' ' HA ' ' A' ' 46' ' ' ARG . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.573 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 1.087 ' H ' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.25 10.44 78.53 Favored Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.9 m -65.43 -59.42 4.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.887 0.344 . . . . 0.0 110.744 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -68.69 0.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.29 177.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 1.087 HD11 ' H ' ' A' ' 32' ' ' SER . 9.6 mp -48.69 -56.35 8.79 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -174.495 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.62 89.71 1.07 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -169.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.59 0.56 33.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -168.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 m -96.91 8.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -176.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.46 9.8 0.05 OUTLIER Glycine 0 CA--C 1.52 0.402 0 C-N-CA 118.926 -1.607 . . . . 0.0 115.311 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -110.63 -97.34 0.41 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 118.695 1.248 . . . . 0.0 112.228 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.729 ' HB2' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -100.93 160.05 14.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.511 -171.877 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 1.012 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -150.13 143.98 25.41 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.573 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -125.83 94.41 4.11 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 166.812 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.846 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HA ' ' HD2' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.543 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 1.012 ' HE2' ' HB3' ' A' ' 47' ' ' LEU . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.634 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -60.32 -34.56 73.99 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -76.12 -9.54 58.7 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.386 -177.595 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.489 ' NE ' ' HA ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -110.15 -52.58 2.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.242 176.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.0 OUTLIER -73.9 -39.95 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.747 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.61 ' N ' ' HG ' ' A' ' 63' ' ' LEU . . . -83.22 -19.55 62.4 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 175.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -80.38 41.55 2.49 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.87 5.36 1.14 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -172.53 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -78.55 12.39 21.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.944 174.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.59 -108.68 2.56 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 142.14 51.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.258 0.551 . . . . 0.0 109.946 172.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.543 ' HG3' ' N ' ' A' ' 71' ' ' GLY . 0.0 OUTLIER -112.1 -32.14 6.66 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.628 177.646 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.543 ' N ' ' HG3' ' A' ' 70' ' ' MET . . . 130.31 37.05 0.35 Allowed Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 113.464 -1.698 . . . . 0.0 110.773 -174.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -112.93 -158.06 0.64 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.604 -175.665 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.17 -92.61 0.8 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.575 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.02 -103.66 2.15 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -110.92 95.99 5.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.6 t -130.58 136.11 59.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.755 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mtm -68.94 99.17 1.02 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.932 0.396 . . . . 0.0 110.574 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.8 m -112.94 -177.92 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.274 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.5 p -80.34 -13.14 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 169.46 -69.48 0.15 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.359 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 11.0 mm-40 -97.26 146.11 30.78 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.8 Cg_exo -74.82 148.55 36.3 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.433 2.089 . . . . 0.0 111.413 178.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.31 166.37 11.35 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.542 -177.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.37 98.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.92 34.92 4.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.091 -173.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.38 -37.48 3.66 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.7 -164.39 31.99 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.741 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 33.4 mt-10 38.36 80.09 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.627 0.771 . . . . 0.0 113.053 174.637 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.0 -147.32 0.36 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.611 177.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -92.07 -85.68 1.5 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.546 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -124.57 -118.02 0.28 Allowed 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.775 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 62.88 -6.35 0.17 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.432 0.693 . . . . 0.0 112.291 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.578 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.9 t70 -92.94 -11.08 34.23 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.582 -175.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.405 ' HG3' HG13 ' A' ' 97' ' ' ILE . 10.5 pm0 -52.13 142.13 17.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.077 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' A' ' 51' ' ' LEU . 2.5 ttp85 -55.17 -77.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.039 -173.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.52 85.73 2.37 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.457 -175.49 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.753 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.512 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.646 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -136.09 -87.66 0.33 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLN . . . . . 0.434 ' H ' ' HB ' ' A' ' 103' ' ' THR . 2.5 mt-30 -136.0 44.77 2.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.575 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.51 ' HD2' ' HB2' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -76.88 65.18 2.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.458 0.647 . . . . 0.0 109.893 176.231 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -61.12 1.88 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.993 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' A' ' 114' ' ' GLU . . . -131.13 -51.83 1.03 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.393 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ALA . . . . . 0.835 ' HB3' ' HB3' ' A' ' 113' ' ' ASP . . . -103.66 148.0 26.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.269 175.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -88.25 45.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.281 -174.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -103.61 -123.76 5.32 Favored Glycine 0 C--N 1.321 -0.284 0 C-N-CA 120.453 -0.879 . . . . 0.0 111.057 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.405 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 2.1 mt -88.82 -100.27 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.405 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 13.0 t0 -107.79 77.76 1.15 Allowed 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 169.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.835 ' HB3' ' HB3' ' A' ' 108' ' ' ALA . 12.1 t0 -115.45 150.72 36.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.863 -177.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.806 ' HA ' ' HB3' ' A' ' 107' ' ' ALA . 1.0 OUTLIER . . . . . 0 C--N 1.316 -0.857 0 CA-C-O 118.885 -0.578 . . . . 0.0 109.656 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.745 -0.542 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -35.32 79.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.023 0.439 . . . . 0.0 111.06 -177.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.569 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp -121.14 -105.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.967 178.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.584 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.584 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.569 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.978 ' HB3' ' HA ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.88 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.575 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.853 ' HA ' HG13 ' A' ' 43' ' ' VAL . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.727 ' HA ' ' O ' ' A' ' 46' ' ' ARG . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.791 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.742 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.594 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.742 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 102.93 6.89 45.31 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.9 m -89.48 -113.74 0.07 Allowed 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.791 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 0.0 OUTLIER -158.13 152.73 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.664 0.269 . . . . 0.0 111.288 178.851 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -113.66 32.81 5.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 178.549 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 138.75 -66.32 0.53 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.244 -0.743 . . . . 0.0 111.244 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.537 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 3.1 mm-40 -86.22 -119.45 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.851 0.358 . . . . 0.0 110.038 175.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.853 HG13 ' HA ' ' A' ' 29' ' ' ASP . 1.2 p -158.77 147.13 8.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 178.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.484 ' N ' ' HB2' ' A' ' 32' ' ' SER . . . 160.2 -168.61 35.86 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 119.5 -1.334 . . . . 0.0 113.877 -175.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.836 ' HG2' ' HG2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -132.09 -23.85 2.16 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -175.0 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.836 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -124.28 152.48 42.98 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.08 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -154.28 -161.71 1.28 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.837 0.29 . . . . 0.0 110.71 -176.654 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.47 ' CE1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -67.94 144.77 55.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.849 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.762 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.806 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.952 ' HA ' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.531 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.557 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.806 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -65.88 -28.6 69.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.587 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.5 OUTLIER -79.01 -0.54 31.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.285 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.557 ' HD2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -105.41 -48.21 3.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.847 0.356 . . . . 0.0 110.822 177.576 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.01 -35.71 25.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.463 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.96 -20.75 30.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.587 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -88.4 41.34 3.06 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 174.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -11.25 35.22 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.63 0.772 . . . . 0.0 112.996 -173.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.455 ' HA3' ' HB2' ' A' ' 72' ' ' SER . . . -76.07 -24.72 68.27 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.657 -177.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.74 -16.97 43.08 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.453 ' HB3' ' H ' ' A' ' 70' ' ' MET . 0.4 OUTLIER -88.94 -132.94 0.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.801 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.489 ' HB3' ' HG2' ' A' ' 85' ' ' MET . 0.0 OUTLIER -65.91 -30.29 70.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 176.108 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -179.14 -63.92 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.892 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 41.39 57.78 2.84 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.774 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.677 ' O ' ' HA3' ' A' ' 87' ' ' GLY . . . 171.26 -162.53 35.25 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.426 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.92 97.03 0.54 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.445 178.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -95.73 101.8 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.209 -0.664 . . . . 0.0 109.209 175.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.43 HG23 ' HB2' ' A' ' 88' ' ' GLU . 0.1 OUTLIER -133.66 164.48 34.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.467 -174.616 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.5 mtt -63.35 149.05 46.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.89 0.376 . . . . 0.0 110.964 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.18 103.13 6.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.08 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.57 ' HB ' HD23 ' A' ' 51' ' ' LEU . 3.5 t -110.92 -37.95 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.583 -179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.74 44.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.583 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' A' ' 88' ' ' GLU . 4.7 mp0 -64.25 111.68 6.03 Favored Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 123.033 0.533 . . . . 0.0 111.413 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD2' ' HA2' ' A' ' 90' ' ' GLY . 3.2 Cg_exo -79.16 -80.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.238 2.625 . . . . 0.0 112.188 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 101.3 11.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.887 -176.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.8 mt -91.88 115.09 27.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.248 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' MET . . . . . 0.489 ' HG2' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -106.17 36.13 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.737 -174.953 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 112.33 -30.78 7.36 Favored Glycine 0 N--CA 1.453 -0.219 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -174.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . 0.677 ' HA3' ' O ' ' A' ' 73' ' ' GLY . . . -129.54 -161.96 10.7 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 175.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.571 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 22.1 mt-10 -102.42 83.65 2.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.632 0.73 . . . . 0.0 112.015 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.731 ' HB3' ' OH ' ' A' ' 60' ' ' TYR . 17.0 m-85 -102.73 -173.27 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.896 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.404 ' HA2' ' HD2' ' A' ' 82' ' ' PRO . . . -106.26 -100.2 2.64 Favored Glycine 0 N--CA 1.44 -1.045 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.014 179.206 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 3.3 p-10 -107.78 -120.85 0.25 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.078 0.466 . . . . 0.0 111.164 -174.234 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 91' ' ' ASP . 3.3 mm-40 -153.08 -50.47 0.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.191 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -142.66 -31.04 0.52 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.529 177.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.45 ' HB3' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER 59.87 -102.7 0.14 Allowed 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.352 0.407 . . . . 0.0 110.185 -178.186 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.557 ' HB3' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.0 -14.31 8.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.583 176.543 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.434 ' C ' HG13 ' A' ' 97' ' ' ILE . 30.4 mt 49.39 -106.98 0.22 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 110.853 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.739 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.88 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.423 HD21 HD22 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m -161.52 -61.54 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.73 -68.21 0.38 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.038 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.978 ' HA ' ' HB3' ' A' ' 16' ' ' ARG . 1.8 m-85 -143.8 -128.83 0.08 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' H ' ' HB3' ' A' ' 105' ' ' PHE . 42.3 t0 -115.86 -68.27 0.93 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 167.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -163.53 22.33 0.08 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.904 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 69.57 -73.16 0.09 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.349 0.659 . . . . 0.0 110.062 -174.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -94.08 45.07 1.13 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.598 171.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.38 -143.17 5.79 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.528 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 2.6 mt -127.78 -31.43 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.13 0.49 . . . . 0.0 110.427 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.45 11.52 32.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.665 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.07 171.09 15.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.068 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.499 -0.762 . . . . 0.0 109.913 178.042 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 112.016 -0.434 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 m -91.97 143.45 26.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.94 0.4 . . . . 0.0 111.07 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.764 HD13 HD21 ' A' ' 102' ' ' ASN . 0.8 OUTLIER -125.11 -72.98 0.65 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.619 178.473 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.696 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 5.4 t30 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.738 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.867 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.557 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.616 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.0 mp0 -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.867 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.616 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.89 ' HA ' HD12 ' A' ' 19' ' ' LEU . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.439 HD12 ' CG ' ' A' ' 26' ' ' TRP . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.509 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.547 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 84.5 -2.57 87.84 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -83.75 0.17 Allowed 'General case' 0 C--N 1.322 -0.597 0 O-C-N 122.775 -0.25 . . . . 0.0 111.232 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HB3' ' H ' ' A' ' 40' ' ' LEU . 2.8 mtt85 -157.98 -149.07 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.464 ' H ' ' HB3' ' A' ' 39' ' ' ARG . 4.4 mt -119.5 77.55 1.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.02 17.62 37.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.221 -177.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.537 ' OE1' ' HG2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.07 -158.29 0.66 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.5 t -65.8 105.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.56 70.3 0.22 Allowed Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.234 -173.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -116.16 -39.27 3.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 172.801 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HG3' ' HE1' ' A' ' 48' ' ' TYR . 7.6 ptm180 -137.1 98.32 3.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.27 173.568 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.84 110.71 20.14 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 -174.302 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.578 ' HE1' ' HG3' ' A' ' 46' ' ' ARG . 5.4 m-85 -85.87 97.62 10.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.257 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.485 ' HG3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 60' ' ' TYR . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.777 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.553 HH11 ' HE1' ' A' ' 60' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.537 ' HG2' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.89 ' HB2' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.777 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -69.38 -26.48 64.68 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.754 HD21 ' HG2' ' A' ' 88' ' ' GLU . 0.3 OUTLIER -58.27 -21.55 49.1 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.465 ' HD2' ' HA ' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -61.55 -29.89 70.3 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.195 176.364 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.43 10.18 6.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.896 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.476 ' CA ' ' HA3' ' A' ' 90' ' ' GLY . . . -141.73 3.64 2.08 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.389 -172.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.716 ' CA ' ' HG ' ' A' ' 61' ' ' LEU . . . -71.46 40.5 0.62 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.626 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 26.22 39.98 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.6 1.56 . . . . 0.0 115.172 179.432 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -143.67 -121.51 1.57 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 171.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' HA ' ' A' ' 89' ' ' PHE . . . 63.93 -97.29 0.22 Allowed Glycine 0 CA--C 1.512 -0.101 0 C-N-CA 121.461 -0.4 . . . . 0.0 113.114 172.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -46.47 90.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 -178.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -24.34 62.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.516 -179.016 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 135.35 -138.89 10.33 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.722 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.6 m -79.25 116.07 19.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 0.0 110.516 178.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.32 -24.06 9.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.467 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -178.32 90.51 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -82.51 95.28 7.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.957 0.408 . . . . 0.0 110.38 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.83 159.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.597 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.7 mtm -77.62 131.74 37.93 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 15.6 t 54.97 83.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.638 177.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.15 -16.92 7.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.953 0.406 . . . . 0.0 110.078 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 119.16 111.61 2.42 Favored Glycine 0 N--CA 1.445 -0.739 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 80' ' ' GLY . 13.5 mm-40 70.61 156.55 0.16 Allowed Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 122.897 0.479 . . . . 0.0 110.786 -176.61 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -54.38 144.25 62.17 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.285 1.99 . . . . 0.0 112.287 -178.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.66 143.95 30.98 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.62 -174.765 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.586 ' H ' ' HE2' ' A' ' 89' ' ' PHE . 7.0 mt -81.41 -176.41 6.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 41.9 ttp -54.69 -40.31 69.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.888 0.375 . . . . 0.0 110.339 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.17 134.06 11.88 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.52 -0.847 . . . . 0.0 111.036 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.65 146.75 22.57 Favored Glycine 0 CA--C 1.506 -0.511 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 61' ' ' LEU . 15.5 mt-10 61.81 110.82 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.333 0.653 . . . . 0.0 110.623 -177.486 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.59 ' HA ' ' N ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -123.61 130.59 52.89 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.511 -168.767 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.476 ' HA3' ' CA ' ' A' ' 64' ' ' GLY . . . 173.56 -98.73 0.13 Allowed Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 118.664 -1.731 . . . . 0.0 114.427 171.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.56 -113.64 0.34 Allowed 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.168 -1.016 . . . . 0.0 111.396 -168.057 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.55 -56.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.362 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -136.17 -39.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.458 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 56.87 -150.96 0.43 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.474 175.039 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.478 ' HB3' ' CE1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -129.27 127.98 42.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.389 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -115.99 134.74 54.65 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 49' ' ' TYR . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.646 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.764 HD21 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.22 106.43 15.0 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.84 -9.77 1.82 Allowed 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 112.499 -2.137 . . . . 0.0 110.076 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -123.39 89.06 3.03 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.587 0.708 . . . . 0.0 109.825 -177.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.33 -38.64 68.59 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.309 -177.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.435 ' H ' ' CG ' ' A' ' 113' ' ' ASP . . . 65.47 57.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.381 -1.281 . . . . 0.0 110.067 -176.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.24 67.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.121 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -117.63 40.8 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.509 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.58 -157.98 17.35 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.256 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -73.16 -21.84 19.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.983 0.421 . . . . 0.0 110.488 179.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -84.84 66.84 9.88 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 174.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . 0.435 ' CG ' ' H ' ' A' ' 107' ' ' ALA . 34.4 t0 -68.07 161.07 27.61 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.457 -174.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.75 177.481 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.256 -0.338 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.68 164.26 18.72 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.202 0.201 . . . . 0.0 110.471 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.465 HD12 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt -66.48 -78.74 0.05 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.425 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' CYS . . . . . 0.625 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.625 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.423 HG23 ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' HD12 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.636 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.816 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.648 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.971 HD22 ' HB ' ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.662 ' HE3' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . 0.785 HG12 ' HG ' ' A' ' 47' ' ' LEU . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB2' ' HA3' ' A' ' 44' ' ' GLY . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.425 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.9 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.648 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.867 ' HH2' ' HA ' ' A' ' 42' ' ' GLU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.802 HD12 HG21 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.843 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.13 -3.58 0.48 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 89.4 m -104.88 -125.47 0.22 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 117.871 0.836 . . . . 0.0 110.744 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -171.7 92.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -176.249 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.843 HD12 ' HA ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -70.37 93.64 0.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 0.0 110.563 176.906 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.8 52.57 0.86 Allowed Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.867 ' HA ' ' HH2' ' A' ' 26' ' ' TRP . 2.9 pp20? -74.56 178.75 5.11 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -173.122 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.3 p -161.57 25.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 122.238 1.018 . . . . 0.0 109.451 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.539 ' HA3' HG22 ' A' ' 22' ' ' ILE . . . -121.07 -167.17 13.2 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.091 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -124.54 -37.46 2.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.86 0.33 . . . . 0.0 111.408 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -76.87 66.35 2.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -175.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.785 ' HG ' HG12 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -157.49 151.64 24.65 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 175.127 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.672 ' H ' HD22 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -77.75 91.33 4.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 178.439 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.882 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.882 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.875 ' HG2' ' HB3' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.58 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.694 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -59.91 -35.02 73.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.573 HD12 ' HA3' ' A' ' 65' ' ' GLY . 3.7 tp -69.4 -19.07 63.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.122 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.67 -19.77 25.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.77 -175.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -122.37 -45.55 2.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -175.404 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.98 38.37 1.82 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.182 -1.009 . . . . 0.0 112.742 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.573 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -117.81 -104.96 2.28 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.323 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.17 41.29 3.55 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 28.78 44.04 0.04 OUTLIER Glycine 0 C--N 1.343 0.956 0 O-C-N 124.358 1.036 . . . . 0.0 114.818 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.448 ' O ' ' HG ' ' A' ' 61' ' ' LEU . . . 138.5 -122.03 2.3 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' HIS . . . . . 0.588 ' CG ' ' H ' ' A' ' 70' ' ' MET . 8.4 t-80 -179.96 -147.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.588 ' H ' ' CG ' ' A' ' 69' ' ' HIS . 0.4 OUTLIER -103.97 -16.97 15.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.361 175.458 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -149.66 107.83 0.37 Allowed Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.539 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . 0.457 ' HB3' ' HA3' ' A' ' 86' ' ' GLY . 0.1 OUTLIER -93.11 106.59 18.53 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.222 0.209 . . . . 0.0 110.485 -179.084 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -49.23 112.04 1.19 Allowed Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.694 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 167.65 -129.0 1.81 Allowed Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 -176.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.97 94.83 2.81 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.096 0.474 . . . . 0.0 111.214 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.456 HG12 HG12 ' A' ' 78' ' ' VAL . 15.3 t -131.98 110.45 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.52 176.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 19.6 mtt -79.43 97.89 6.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.805 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 81' ' ' GLU . 12.9 p 171.46 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.899 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.32 -41.43 83.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.17 60.55 4.83 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.292 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.514 ' HA ' HG13 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -53.64 125.75 46.56 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.19 -177.08 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.639 ' HD2' HD21 ' A' ' 84' ' ' LEU . 16.9 Cg_exo -70.2 -170.18 0.4 Allowed 'Trans proline' 0 CA--C 1.529 0.234 0 C-N-CA 122.972 2.448 . . . . 0.0 112.132 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.39 63.66 1.82 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.472 -178.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.671 HD22 ' H ' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -70.93 -179.44 2.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.633 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -46.6 58.11 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.457 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . 48.21 -117.15 3.49 Favored Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 113.37 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 151.76 -41.56 0.73 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.794 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.59 102.25 13.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -106.47 -150.12 0.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.288 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.49 94.66 0.16 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.1 -0.572 . . . . 0.0 111.68 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.875 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -68.03 -92.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.912 0.085 . . . . 0.0 111.061 -177.398 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 67.94 -13.23 0.27 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.24 0.616 . . . . 0.0 112.323 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASP . . . . . 0.439 ' H ' ' C ' ' A' ' 91' ' ' ASP . 13.9 p-10 -77.16 -31.65 55.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.259 -176.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.03 156.01 45.89 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.059 0.457 . . . . 0.0 110.903 -179.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.23 130.29 39.9 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.551 179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt -101.84 -175.06 2.74 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.734 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.971 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.532 ' HA ' ' HD2' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.662 HD22 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.816 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.636 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 0.2 OUTLIER -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m -84.28 -59.66 2.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -84.11 46.42 1.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.73 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.454 ' HB2' ' HD3' ' A' ' 16' ' ' ARG . 30.2 t80 -83.03 -71.39 0.5 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.18 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.07 -74.74 0.09 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.913 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 51.03 64.3 1.9 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.012 173.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -94.81 -149.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.67 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -120.81 44.62 2.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.136 0.493 . . . . 0.0 110.804 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.5 -146.37 4.48 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.833 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ILE . . . . . 0.438 ' H ' HG12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -107.89 25.27 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.091 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -102.5 9.69 39.37 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.505 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.42 98.08 10.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.743 177.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.345 -176.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.521 -0.146 0 CA-C-O 121.133 0.492 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.807 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.593 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.807 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.595 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.555 ' O ' HD22 ' A' ' 19' ' ' LEU . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.944 HD12 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' GLN . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.837 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.579 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.494 ' CD1' HG21 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.43 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.55 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.486 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 35' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.51 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--O 1.236 0.355 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.944 ' HB ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.458 ' O ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m . . . . . 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 12' ' ' ASN . 4.0 mt . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.535 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.717 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.757 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.731 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.494 ' HG ' ' HG2' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.517 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.704 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.704 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 31' ' ' LEU . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.527 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.808 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.892 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.322 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD12 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.504 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.782 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.436 ' HB2' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.782 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.892 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.468 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--O 1.233 0.202 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.517 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.731 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.777 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HG3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.537 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 1.017 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.907 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.907 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.931 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.931 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.739 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.744 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.99 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.482 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.99 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.739 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.53 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' H ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 1.017 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.513 HH11 ' HG3' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.537 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.816 HD12 ' HB2' ' A' ' 4' ' ' LEU . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.461 ' HG3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.549 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 97' ' ' ILE . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.568 HD11 HD21 ' A' ' 31' ' ' LEU . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.453 ' H ' ' H ' ' A' ' 24' ' ' GLN . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.453 ' H ' ' H ' ' A' ' 23' ' ' ASP . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.842 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.467 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 HD11 ' A' ' 22' ' ' ILE . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.719 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.245 0 CA-C-O 121.526 0.679 . . . . 0.0 110.168 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.736 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.516 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.49 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.508 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.469 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.66 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.545 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.46 ' HG ' ' CE2' ' A' ' 48' ' ' TYR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.614 HG22 ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.613 HD21 HG23 ' A' ' 103' ' ' THR . 1.1 mp . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.677 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.513 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.795 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 28' ' ' GLU . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.816 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.531 ' HB3' HG12 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.741 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.816 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.432 ' CD2' HD21 ' A' ' 31' ' ' LEU . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.795 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.432 HD21 ' CD2' ' A' ' 26' ' ' TRP . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.845 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.676 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.588 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.845 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.476 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.676 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.408 HD21 ' HA ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER . . . . . 0 CA--C 1.535 0.392 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.741 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.516 ' N ' HG22 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.424 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.613 HG23 HD21 ' A' ' 3' ' ' LEU . 1.2 m . . . . . 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt . . . . . 0 N--CA 1.457 -0.078 0 CA-C-O 120.662 0.268 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.758 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.732 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.732 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.758 HD12 ' HB2' ' A' ' 4' ' ' LEU . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.403 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.615 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.721 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.968 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.625 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.968 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.625 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.721 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.951 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.951 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.497 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 80.1 t80 . . . . . 0 N--CA 1.442 -0.873 0 CA-C-O 120.964 0.411 . . . . 0.0 110.341 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.871 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.871 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.673 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.497 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.673 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.416 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.563 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.8 mp . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 120.789 0.328 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.557 ' HD2' HD21 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.794 HD13 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m . . . . . 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt . . . . . 0 C--O 1.234 0.267 0 CA-C-O 120.748 0.308 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.624 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.468 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.554 HD12 ' HB2' ' A' ' 4' ' ' LEU . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.454 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.6 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.629 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.581 HD22 HG22 ' A' ' 97' ' ' ILE . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.992 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.592 ' HB3' ' C ' ' A' ' 96' ' ' LEU . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.71 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 55' ' ' LEU . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.695 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.887 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 N--CA 1.45 -0.45 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.562 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.825 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 60' ' ' TYR . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.611 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.887 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.611 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.581 HG22 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.6 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.629 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.431 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.451 -0.406 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.428 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.887 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.887 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 3' ' ' LEU . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' CD2' ' A' ' 27' ' ' HIS . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.591 ' O ' HD22 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.591 HD22 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.015 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ASP . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.473 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 1.015 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.516 HD13 ' CG2' ' A' ' 97' ' ' ILE . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.925 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 59' ' ' ASP . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.925 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 . . . . . 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 1.017 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.482 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 1.017 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.503 HD22 ' HB2' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.451 ' CG ' HD23 ' A' ' 35' ' ' LEU . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 N-CA-C 109.465 -0.569 . . . . 0.0 109.465 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m . . . . . 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.761 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.483 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.862 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.627 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.761 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 17' ' ' TYR . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.915 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.948 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.552 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.436 ' H ' ' H ' ' A' ' 24' ' ' GLN . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.436 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.948 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 1.041 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.692 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.755 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.452 -0.338 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HB2' HD22 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.862 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.041 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.412 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.755 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.559 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.915 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.695 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m . . . . . 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.233 0.224 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.401 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.417 HD12 ' HB2' ' A' ' 4' ' ' LEU . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.883 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.616 HD22 ' HB ' ' A' ' 97' ' ' ILE . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.773 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.462 ' H ' ' H ' ' A' ' 24' ' ' GLN . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.773 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.749 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.422 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.517 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.851 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.771 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 CA--C 1.52 -0.182 0 CA-C-O 120.722 0.296 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.616 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.41 ' O ' HD23 ' A' ' 19' ' ' LEU . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.883 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.49 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.424 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 19.2 t-20 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.519 HG23 ' NE2' ' A' ' 27' ' ' HIS . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.629 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.656 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.982 HD22 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.435 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.938 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 56' ' ' CYS . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.405 ' HE2' ' HG3' ' A' ' 57' ' ' ARG . 3.8 m-85 . . . . . 0 C--O 1.232 0.161 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.523 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.523 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.536 ' SG ' ' HB2' ' A' ' 58' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.651 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.536 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.651 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.484 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.982 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.74 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.74 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.485 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.504 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.9 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.9 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.84 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.673 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.673 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.516 -0.329 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 1.056 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.5 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.467 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 1.056 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.432 ' HA ' ' HB3' ' A' ' 60' ' ' TYR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.61 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 pp . . . . . 0 N--CA 1.452 -0.333 0 CA-C-O 120.638 0.256 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.75 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.485 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.479 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' H ' ' A' ' 103' ' ' THR . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.4 ' H ' ' HB3' ' A' ' 102' ' ' ASN . 1.8 m . . . . . 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.235 0.305 0 CA-C-O 120.865 0.364 . . . . 0.0 110.431 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.571 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.524 ' NE2' ' HE1' ' A' ' 27' ' ' HIS . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.536 HD12 ' HG ' ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.688 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.611 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.829 HD22 ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.852 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.852 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.406 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 6.6 m80 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.406 ' HG ' ' CG ' ' A' ' 26' ' ' TRP . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.64 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.778 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . . . . . . 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.443 -0.809 0 CA-C-O 120.88 0.371 . . . . 0.0 111.068 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.696 ' HB2' HD22 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.681 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.696 HD22 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.482 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.829 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.812 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.611 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.688 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t . . . . . 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 C--O 1.232 0.173 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.56 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.63 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.63 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.56 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.538 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.595 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.877 HD21 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 1.005 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.497 HD12 ' CZ2' ' A' ' 26' ' ' TRP . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 1.005 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.919 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD12 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.919 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 . . . . . 0 N--CA 1.455 -0.175 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 1.021 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.543 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 1.021 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.593 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HD3' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.538 ' HA ' ' HD3' ' A' ' 58' ' ' ARG . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.441 ' H ' ' HB2' ' A' ' 56' ' ' CYS . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.449 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.438 ' C ' HG13 ' A' ' 97' ' ' ILE . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.253 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.877 ' HD2' HD21 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' HD21 ' A' ' 12' ' ' ASN . 1.2 mt . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.473 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.645 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.645 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.44 HD21 ' HB2' ' A' ' 3' ' ' LEU . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.438 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.545 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.402 ' HD2' ' HE ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.856 HD22 ' HB ' ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.667 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.667 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.875 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.493 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.819 ' HB3' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.538 ' CE2' HG23 ' A' ' 22' ' ' ILE . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.51 ' HB2' HD23 ' A' ' 55' ' ' LEU . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.468 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.529 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.819 HD13 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.656 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 11.9 mt . . . . . 0 N--CA 1.461 0.09 0 CA-C-O 120.789 0.328 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.856 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.58 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m . . . . . 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.787 0.327 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.473 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.439 ' HB ' ' OE1' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.688 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.552 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.552 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.473 HD12 ' CB ' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.42 ' HG3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.641 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.74 HD22 HD13 ' A' ' 97' ' ' ILE . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.722 HD13 ' HG2' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.414 HD13 ' CD1' ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.531 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.531 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HG3' ' A' ' 57' ' ' ARG . 1.4 t80 . . . . . 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.449 ' HB3' ' N ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.637 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.722 ' HG2' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.436 ' HG3' ' CE2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.449 ' N ' ' HB3' ' A' ' 49' ' ' TYR . 0.4 OUTLIER . . . . . 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.74 HD13 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.586 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m . . . . . 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt . . . . . 0 C--O 1.232 0.14 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.61 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.61 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' A' ' 27' ' ' HIS . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.646 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.954 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.547 HG12 ' O ' ' A' ' 96' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.954 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HE1' HG13 ' A' ' 22' ' ' ILE . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.573 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.573 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.218 -0.565 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.846 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.442 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.543 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.846 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.634 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 120.508 0.194 . . . . 0.0 111.457 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.753 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.512 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.646 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.569 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp . . . . . 0 N--CA 1.455 -0.187 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.584 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.584 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.569 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.452 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.88 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.575 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.554 HD22 HG21 ' A' ' 97' ' ' ILE . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.402 ' HB3' ' H ' ' A' ' 33' ' ' CYS . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.742 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.594 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.742 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.47 ' CE1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.146 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.849 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.762 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.806 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.689 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.531 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.806 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . 0.434 ' C ' HG13 ' A' ' 97' ' ' ILE . 30.4 mt . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.565 0.221 . . . . 0.0 110.853 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.739 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.88 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.423 HD21 HD22 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.764 HD13 HD21 ' A' ' 102' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.455 -0.198 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.696 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 5.4 t30 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.738 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.867 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.557 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.616 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.867 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.616 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.89 ' HA ' HD12 ' A' ' 19' ' ' LEU . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.439 HD12 ' CG ' ' A' ' 26' ' ' TRP . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.509 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.547 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . . . . . . 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.539 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 5.4 m-85 . . . . . 0 CA--C 1.512 -0.497 0 CA-C-O 120.68 0.276 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.485 ' HG3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 60' ' ' TYR . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.777 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.553 HH11 ' HE1' ' A' ' 60' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' HA ' ' HD2' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.89 ' HB2' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.777 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.261 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 49' ' ' TYR . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.646 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.764 HD21 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.465 HD12 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLY . . . . . 0.425 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' CYS . . . . . 0.625 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.625 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.423 HG23 ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' HD12 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.636 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.816 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.648 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.971 HD22 ' HB ' ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.662 ' HE3' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . 0.708 HD11 HD11 ' A' ' 31' ' ' LEU . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.42 ' H ' ' H ' ' A' ' 24' ' ' GLN . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.425 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.9 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.648 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.594 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.802 HD12 HG21 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.628 ' HB2' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.882 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.882 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.58 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.694 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.971 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.532 ' HD2' ' HA ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.662 HD22 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . 0.816 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.636 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 48.2 t-20 -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m . . . . . 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.763 0 N-CA-C 112.001 -0.44 . . . . 0.0 112.001 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.504 ' HA ' ' OD1' ' A' ' 12' ' ' ASN . 1.3 m -82.86 121.04 26.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.936 0.398 . . . . 0.0 111.148 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.687 HD21 ' HG3' ' A' ' 104' ' ' GLN . 0.5 OUTLIER -115.77 -67.17 1.01 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.242 179.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.807 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -116.2 165.62 12.95 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.084 175.783 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -123.63 128.93 50.39 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 120.312 -0.555 . . . . 0.0 111.336 176.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.622 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -83.28 149.82 26.53 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.238 -178.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -94.05 -1.56 65.01 Favored Glycine 0 N--CA 1.448 -0.525 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.548 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.01 -51.46 2.61 Favored Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.889 -0.672 . . . . 0.0 111.974 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.593 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 20.7 p -108.26 -21.43 12.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.778 0.323 . . . . 0.0 110.81 178.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.505 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.2 OUTLIER 60.75 21.8 11.8 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.054 178.102 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.593 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -96.08 13.81 25.93 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.519 0.199 . . . . 0.0 111.314 -177.779 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.536 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER 77.22 145.36 0.09 Allowed 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.694 -0.684 . . . . 0.0 111.375 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.807 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.0 mt -102.49 99.19 7.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.943 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -104.07 18.05 46.93 Favored Glycine 0 N--CA 1.45 -0.398 0 N-CA-C 110.769 -0.932 . . . . 0.0 110.769 175.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -77.15 177.65 7.67 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.634 -0.783 . . . . 0.0 110.677 -176.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.443 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.41 -31.68 16.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.057 0.456 . . . . 0.0 110.247 176.524 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.595 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -117.08 157.68 25.47 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.555 ' O ' HD22 ' A' ' 19' ' ' LEU . 2.5 p90 -163.39 161.53 24.44 Favored 'General case' 0 CA--C 1.504 -0.812 0 CA-C-O 121.459 0.647 . . . . 0.0 110.402 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.944 HD12 ' HB ' ' A' ' 97' ' ' ILE . 2.9 mm? -124.06 141.97 51.59 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.261 -174.126 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.837 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.41 151.83 17.64 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 -178.26 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.472 ' HB3' HD13 ' A' ' 47' ' ' LEU . . . 179.21 -43.36 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.763 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 8.3 mt -52.16 -54.33 14.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.316 -173.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.404 ' H ' ' H ' ' A' ' 24' ' ' GLN . 12.8 t70 176.5 -12.19 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.264 1.03 . . . . 0.0 108.49 -178.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.763 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -130.82 -168.6 2.01 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 114.155 -1.384 . . . . 0.0 109.145 -178.921 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.837 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -110.05 158.04 18.69 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 178.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.579 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 88.8 m95 -136.73 -167.14 2.02 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.607 0.718 . . . . 0.0 111.492 -173.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.7 m80 -122.7 164.68 17.83 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.16 174.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -65.77 -46.43 78.79 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 120.768 0.318 . . . . 0.0 111.369 178.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.55 -1.87 52.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.236 0.541 . . . . 0.0 111.177 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.953 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 2.6 m -89.91 -42.73 11.04 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.808 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.494 ' CD1' HG21 ' A' ' 97' ' ' ILE . 0.5 OUTLIER -70.96 75.58 0.64 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.527 -179.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.11 -179.03 3.82 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.049 176.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.495 ' SG ' ' N ' ' A' ' 34' ' ' ASP . 0.0 OUTLIER -83.7 166.94 17.66 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.309 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.495 ' N ' ' SG ' ' A' ' 33' ' ' CYS . 1.3 t70 -93.42 -46.06 7.51 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -177.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.567 ' HB3' ' CG ' ' A' ' 59' ' ' ASP . 8.5 tp -121.7 -47.04 2.22 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -170.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -58.63 -41.23 85.48 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 119.376 0.989 . . . . 0.0 109.686 177.433 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.94 42.21 8.27 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.695 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 1.6 p -110.68 -118.22 0.29 Allowed 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 -179.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.528 ' C ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -170.83 43.66 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.278 177.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 97' ' ' ILE . 0.0 OUTLIER 43.01 -112.7 0.22 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 115.17 -0.923 . . . . 0.0 112.712 176.541 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.64 ' O ' ' HA ' ' A' ' 96' ' ' LEU . . . -172.84 89.09 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.842 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 -178.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -71.31 56.05 0.23 Allowed 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -173.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.607 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 2.7 t -122.24 92.45 2.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -40.01 112.56 0.3 Allowed Glycine 0 C--N 1.328 0.136 0 CA-C-N 114.956 -1.02 . . . . 0.0 114.548 -171.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.438 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 0.5 OUTLIER -158.97 -93.08 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 177.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.438 ' H ' ' HB3' ' A' ' 45' ' ' ARG . 1.1 mmp_? -104.12 -169.85 1.69 Allowed 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.833 178.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.758 HD21 HG12 ' A' ' 22' ' ' ILE . 0.8 OUTLIER -155.65 148.79 24.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.897 0.379 . . . . 0.0 110.578 173.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.749 ' HB2' ' HA ' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -129.38 119.07 23.23 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.361 -179.714 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.455 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 3.3 p90 -159.78 158.57 31.42 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.67 165.07 11.28 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.348 -178.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.55 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -29.59 -50.0 0.1 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.55 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.23 18.69 3.93 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.242 -0.98 . . . . 0.0 112.514 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -130.39 131.23 45.18 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.856 -0.203 . . . . 0.0 111.048 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -86.08 59.31 5.56 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 170.82 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -104.73 144.03 32.3 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.839 -175.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.805 ' HA ' HH12 ' A' ' 95' ' ' ARG . 11.3 m -70.36 164.84 23.66 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.675 -175.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.641 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 2.6 tpt180 -67.72 -34.22 76.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.383 173.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.575 HH11 HD22 ' A' ' 61' ' ' LEU . 1.8 mmt180 -74.36 -30.81 62.15 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.19 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.567 ' CG ' ' HB3' ' A' ' 35' ' ' LEU . 24.3 m-20 -68.39 -46.3 70.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.445 0.64 . . . . 0.0 109.484 174.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.51 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -66.25 -30.55 71.01 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.137 177.506 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 3.7 tp -75.32 -17.0 60.36 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.138 177.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.99 -20.98 37.36 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.535 -176.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -120.63 -43.85 2.47 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.011 -177.49 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.72 39.18 2.02 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.144 -179.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -124.21 -112.96 2.01 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.433 177.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.411 ' H ' ' HG ' ' A' ' 61' ' ' LEU . 13.7 m -142.61 9.37 1.79 Allowed 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 111.453 0.168 . . . . 0.0 111.453 178.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.607 ' HA3' ' HG2' ' A' ' 88' ' ' GLU . . . -106.72 -122.34 4.91 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 119.703 -1.237 . . . . 0.0 113.04 -176.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 87.81 35.39 9.2 Favored Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.61 -0.805 . . . . 0.0 111.225 -174.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -125.25 -171.75 2.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.74 -48.07 5.08 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.86 0.362 . . . . 0.0 110.084 177.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.409 ' O ' ' HA3' ' A' ' 86' ' ' GLY . . . -69.79 108.86 2.63 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.22 179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.23 159.23 16.26 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.675 0.274 . . . . 0.0 110.958 -177.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.739 ' HA3' ' O ' ' A' ' 83' ' ' THR . . . 107.16 -160.97 13.91 Favored Glycine 0 C--O 1.218 -0.862 0 CA-C-N 116.396 -0.366 . . . . 0.0 112.431 179.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.942 ' H ' ' HA ' ' A' ' 84' ' ' LEU . . . -93.46 148.45 19.02 Favored Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -72.99 95.09 1.95 Allowed 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 117.087 0.443 . . . . 0.0 110.999 -176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -138.34 164.49 26.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.816 178.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 49.2 mtm -52.98 129.98 32.23 Favored 'General case' 0 C--N 1.333 -0.136 0 O-C-N 123.389 0.43 . . . . 0.0 111.086 -179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 47.3 t -76.25 99.58 2.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.951 0.405 . . . . 0.0 110.848 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -111.56 -2.05 10.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.432 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 94.41 44.13 3.54 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 111.339 -0.705 . . . . 0.0 111.339 -177.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -113.01 156.5 42.68 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.89 -175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -69.97 166.06 29.14 Favored 'Trans proline' 0 C--N 1.346 0.396 0 C-N-CA 122.848 2.365 . . . . 0.0 111.382 177.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.739 ' O ' ' HA3' ' A' ' 73' ' ' GLY . 0.2 OUTLIER 53.11 -96.5 0.05 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.836 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.942 ' HA ' ' H ' ' A' ' 74' ' ' GLY . 0.4 OUTLIER -51.08 95.93 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -172.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.47 -47.25 0.42 Allowed 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.754 172.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.409 ' HA3' ' O ' ' A' ' 71' ' ' GLY . . . -123.99 -102.62 1.52 Allowed Glycine 0 CA--C 1.523 0.562 0 C-N-CA 120.832 -0.699 . . . . 0.0 114.064 -174.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -144.38 -29.72 0.1 Allowed Glycine 0 C--N 1.336 0.58 0 C-N-CA 120.162 -1.018 . . . . 0.0 113.94 -175.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.607 ' HG2' ' HA3' ' A' ' 67' ' ' GLY . 3.1 mt-10 -86.48 93.14 9.07 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 117.523 0.661 . . . . 0.0 109.903 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' HA ' ' HA2' ' A' ' 73' ' ' GLY . 22.4 m-85 -59.54 -153.49 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -166.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -116.11 -111.02 2.72 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.964 -172.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.859 ' HA ' ' HG3' ' A' ' 94' ' ' GLU . 5.4 p-10 -122.65 -109.0 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 O-C-N 122.539 -0.389 . . . . 0.0 112.007 -173.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 16.7 mm-40 76.85 -44.92 0.48 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.177 0.991 . . . . 0.0 110.951 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -119.89 3.54 11.04 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.13 176.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.859 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 2.3 mm-40 -78.03 -163.49 0.43 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.473 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.805 HH12 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -67.75 73.78 0.17 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.091 -175.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.64 ' HA ' ' O ' ' A' ' 41' ' ' GLY . 1.5 mt -95.81 76.39 3.19 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.494 0.664 . . . . 0.0 110.054 177.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.944 ' HB ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -67.35 153.07 9.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.654 -175.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.458 ' O ' HD13 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.36 108.77 20.2 Favored 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.778 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.598 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.59 97.73 1.37 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.389 -178.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 1.1 tp -103.33 179.96 4.12 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.248 0.547 . . . . 0.0 111.194 -174.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.424 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -117.24 153.15 33.39 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.133 177.425 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -76.61 155.4 33.55 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.444 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 8.1 m -63.35 -42.27 98.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.687 ' HG3' HD21 ' A' ' 3' ' ' LEU . 10.4 mt-30 -95.07 61.24 2.45 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.284 172.166 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.443 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -72.13 -24.58 61.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.955 -178.015 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -4.16 -68.39 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 126.045 1.738 . . . . 0.0 114.127 176.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.577 ' HB1' ' O ' ' A' ' 110' ' ' GLY . . . 72.32 64.02 0.12 Allowed 'General case' 0 C--O 1.233 0.203 0 O-C-N 124.254 0.971 . . . . 0.0 110.303 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -66.9 -20.8 65.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.288 -0.869 . . . . 0.0 112.069 -175.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -125.33 45.64 2.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.043 0.449 . . . . 0.0 110.865 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.577 ' O ' ' HB1' ' A' ' 107' ' ' ALA . . . 73.86 -111.75 3.56 Favored Glycine 0 C--O 1.226 -0.36 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.0 -178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -94.64 43.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 121.887 0.851 . . . . 0.0 109.777 175.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -160.46 137.91 9.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.731 -1.122 . . . . 0.0 108.597 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -119.63 172.82 7.4 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.92 0.391 . . . . 0.0 111.381 -177.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 . . . . . 0 C--O 1.248 0.987 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.932 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.789 0 N-CA-C 111.83 -0.508 . . . . 0.0 111.83 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -90.9 162.29 14.84 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD13 HD21 ' A' ' 12' ' ' ASN . 4.0 mt -74.51 163.92 27.2 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.834 -0.432 . . . . 0.0 109.834 176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.553 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.3 mp -105.35 163.19 12.8 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.646 -177.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -123.22 127.47 48.65 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.028 0.442 . . . . 0.0 110.825 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -82.63 136.75 34.71 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.926 -179.319 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.2 6.56 71.22 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.384 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.69 -46.62 2.27 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.511 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.535 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.2 p -118.62 -21.45 7.92 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.637 0.256 . . . . 0.0 110.939 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mp0 62.04 25.01 14.96 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.357 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.535 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -91.87 13.52 18.23 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 121.24 -0.184 . . . . 0.0 111.267 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.476 HD21 HD13 ' A' ' 3' ' ' LEU . 19.5 t30 71.65 128.66 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-O 121.326 0.584 . . . . 0.0 110.866 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.553 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.1 mt -82.12 103.64 9.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.565 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -109.47 12.57 33.2 Favored Glycine 0 N--CA 1.445 -0.748 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.205 179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.64 -172.63 1.01 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.057 0.456 . . . . 0.0 110.57 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.717 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 4.5 ppt_? -95.98 -25.01 16.11 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.757 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.9 OUTLIER -141.91 153.97 44.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.399 -178.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.731 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 5.7 p90 -155.68 177.39 11.44 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.322 0.582 . . . . 0.0 111.59 -179.097 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.494 ' HG ' ' HG2' ' A' ' 99' ' ' ARG . 3.3 mt -115.67 146.58 41.71 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.241 -0.891 . . . . 0.0 109.146 177.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.931 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.11 146.23 12.28 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.524 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.517 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 170.48 -47.87 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 O-C-N 123.491 0.494 . . . . 0.0 111.88 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.704 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 12.7 mt -44.17 -46.12 2.24 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.377 -171.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.9 t70 178.97 -22.3 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 122.159 0.98 . . . . 0.0 108.569 179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.79 -169.89 2.57 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.11 -1.405 . . . . 0.0 109.416 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.931 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -92.13 158.95 15.91 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 176.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.704 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 91.5 m95 -139.2 -173.12 3.5 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.322 0.582 . . . . 0.0 110.707 -175.428 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.1 m80 -112.01 158.38 19.6 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.757 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.526 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.8 mt-10 -58.85 -49.73 76.64 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 120.968 0.413 . . . . 0.0 111.152 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.67 8.32 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.818 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 1.06 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.96 -35.26 14.79 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.024 0.44 . . . . 0.0 110.029 175.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.495 HD12 ' HA ' ' A' ' 31' ' ' LEU . 8.0 tp -73.95 70.37 1.49 Allowed 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.68 178.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.8 OUTLIER -121.91 158.74 28.33 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.191 178.585 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.527 ' CB ' ' H ' ' A' ' 37' ' ' GLY . 1.7 m -54.92 163.91 0.91 Allowed 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.381 -177.813 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.71 -57.64 2.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.712 178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.808 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 3.4 tp -82.96 -60.37 2.19 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.762 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.892 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 3.0 m -53.79 -57.06 12.26 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.105 179.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.527 ' H ' ' CB ' ' A' ' 33' ' ' CYS . . . 84.71 15.64 67.6 Favored Glycine 0 N--CA 1.447 -0.567 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.9 175.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -78.02 -90.38 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.078 0.466 . . . . 0.0 110.139 178.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.506 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -165.64 144.09 6.05 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 176.255 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.401 ' HB3' HD21 ' A' ' 47' ' ' LEU . 0.2 OUTLIER -69.91 120.6 15.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.061 0.458 . . . . 0.0 111.483 -175.032 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 112.61 -57.97 0.42 Allowed Glycine 0 N--CA 1.442 -0.937 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.505 -178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HG2' ' O ' ' A' ' 39' ' ' ARG . 11.2 mm-40 49.63 -107.56 0.26 Allowed 'General case' 0 CA--C 1.53 0.196 0 O-C-N 124.058 0.505 . . . . 0.0 110.785 179.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 t -100.25 86.98 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 172.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.02 166.37 17.18 Favored Glycine 0 N--CA 1.443 -0.844 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.806 -175.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.78 9.01 7.58 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.085 0.469 . . . . 0.0 110.515 178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.98 92.01 8.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.104 178.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.695 HD12 HH22 ' A' ' 95' ' ' ARG . 0.2 OUTLIER -86.92 85.23 7.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.27 0.557 . . . . 0.0 111.03 -177.643 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.436 ' CE2' ' HB2' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -94.79 162.51 13.73 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 114.89 -1.05 . . . . 0.0 109.354 173.511 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -156.82 165.59 35.77 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.776 0.322 . . . . 0.0 110.454 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.16 160.8 14.38 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.909 -178.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD12 ' H ' ' A' ' 52' ' ' GLY . 0.0 OUTLIER -31.74 -49.03 0.16 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.247 1.019 . . . . 0.0 113.354 -177.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.504 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -138.82 26.19 2.77 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 120.491 -0.861 . . . . 0.0 111.861 178.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 9.5 mtt180 -135.1 148.48 49.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.671 0.272 . . . . 0.0 110.342 -179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.459 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -108.05 107.73 18.53 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 174.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.403 ' HA ' ' HA ' ' A' ' 33' ' ' CYS . 0.8 OUTLIER -156.11 171.88 19.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.284 -175.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.782 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 21.0 p -79.82 -175.04 4.69 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 121.536 0.684 . . . . 0.0 110.852 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.482 ' NH2' ' HB2' ' A' ' 92' ' ' GLU . 0.0 OUTLIER -89.54 -7.52 54.72 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.85 -179.878 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.782 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -90.21 -51.57 5.38 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.284 -178.562 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.892 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -77.59 -8.32 57.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.723 178.215 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.468 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.83 -42.06 50.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.955 170.194 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.592 ' HB3' ' O ' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -74.18 -49.7 22.45 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.501 -177.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.456 ' HD2' HH11 ' A' ' 62' ' ' ARG . 0.0 OUTLIER -164.08 -86.44 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 175.846 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.437 ' H ' ' HB3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -125.58 -39.67 2.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 168.016 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.423 ' O ' ' HA ' ' A' ' 58' ' ' ARG . . . -120.62 -61.8 0.24 Allowed Glycine 0 N--CA 1.445 -0.717 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.689 174.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.592 ' O ' ' HB3' ' A' ' 61' ' ' LEU . . . -142.39 -107.54 0.63 Allowed Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.765 -0.731 . . . . 0.0 111.871 178.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -93.37 -20.1 20.68 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.768 -0.216 . . . . 0.0 110.593 179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 26.05 43.39 0.02 OUTLIER Glycine 0 N--CA 1.467 0.761 0 O-C-N 124.295 0.997 . . . . 0.0 115.573 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -116.23 -55.8 0.33 Allowed Glycine 0 N--CA 1.448 -0.566 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.724 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -124.8 -91.65 0.53 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.594 0.235 . . . . 0.0 110.546 178.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 4.6 mtp -107.65 -34.92 6.85 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.018 0.437 . . . . 0.0 110.742 179.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 96.88 118.78 3.66 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.57 -0.824 . . . . 0.0 111.148 -174.125 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.577 ' HB2' ' CA ' ' A' ' 86' ' ' GLY . 0.0 OUTLIER -94.09 5.79 50.61 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -172.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.446 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -103.32 -51.7 0.97 Allowed Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.233 174.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 104.12 167.94 24.98 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.075 -0.583 . . . . 0.0 111.975 178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.23 119.47 15.41 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.922 0.391 . . . . 0.0 109.987 -179.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -97.12 120.41 46.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.938 -174.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -82.78 158.95 22.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.454 -179.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.7 t -81.25 66.82 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.308 0.575 . . . . 0.0 109.956 177.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 9.9 p -135.37 9.96 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.012 -174.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 108.85 78.09 1.04 Allowed Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -59.34 123.89 72.37 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-O 120.932 0.396 . . . . 0.0 111.669 -174.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.479 ' O ' ' HA3' ' A' ' 90' ' ' GLY . 88.0 Cg_endo -86.34 -175.6 1.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 122.922 2.415 . . . . 0.0 112.457 -178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 3.1 t -92.16 118.55 30.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.289 0.566 . . . . 0.0 110.336 176.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.61 ' HB2' ' HA ' ' A' ' 89' ' ' PHE . 1.1 mt -119.38 124.8 47.48 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.665 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.78 22.63 7.06 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.209 0.528 . . . . 0.0 111.068 -177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.577 ' CA ' ' HB2' ' A' ' 72' ' ' SER . . . -98.66 -128.72 6.24 Favored Glycine 0 N--CA 1.445 -0.76 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.792 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.453 ' H ' ' C ' ' A' ' 72' ' ' SER . . . -85.52 -71.69 1.31 Allowed Glycine 0 C--O 1.225 -0.421 0 C-N-CA 120.116 -1.04 . . . . 0.0 112.12 179.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.472 ' CG ' ' HA3' ' A' ' 65' ' ' GLY . 2.5 mp0 -83.75 96.96 8.89 Favored 'General case' 0 C--N 1.321 -0.633 0 O-C-N 122.519 -0.4 . . . . 0.0 110.709 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.61 ' HA ' ' HB2' ' A' ' 84' ' ' LEU . 0.1 OUTLIER -77.79 167.51 21.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.224 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 82' ' ' PRO . . . -97.14 -106.92 2.44 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.352 -179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.716 ' HB2' ' HG2' ' A' ' 94' ' ' GLU . 30.4 p-10 -86.91 -84.31 0.18 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 111.846 0.313 . . . . 0.0 111.846 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.619 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 4.3 mt-10 67.57 -45.41 0.49 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.572 1.149 . . . . 0.0 112.531 179.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.9 t0 -135.92 35.16 2.85 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.582 0.705 . . . . 0.0 110.055 -177.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.716 ' HG2' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -77.37 161.56 27.94 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.494 -179.574 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.695 HH22 HD12 ' A' ' 47' ' ' LEU . 1.9 ttp-105 -157.87 -174.01 4.64 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 mt -108.29 -172.19 2.01 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.028 0.442 . . . . 0.0 111.613 -178.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.517 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 0.2 OUTLIER -149.67 140.55 16.8 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.573 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -118.06 127.15 53.52 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.757 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 13.3 mtp180 -96.97 101.01 12.5 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.731 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -102.31 175.07 5.64 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.322 -172.078 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.456 ' HG3' ' HB2' ' A' ' 113' ' ' ASP . 0.8 OUTLIER -102.97 140.98 36.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.096 -0.956 . . . . 0.0 109.756 174.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -82.03 -33.74 29.84 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 172.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.21 -104.91 0.4 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.359 175.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.42 ' HA ' ' HB3' ' A' ' 108' ' ' ALA . 1.0 OUTLIER -168.19 93.51 0.36 Allowed 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 175.813 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -129.65 -57.71 1.12 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.981 -172.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -60.97 -69.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.436 -0.802 . . . . 0.0 111.002 -174.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -139.31 -6.6 1.37 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.42 ' HB3' ' HA ' ' A' ' 104' ' ' GLN . . . -68.29 -11.13 58.95 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.863 0.364 . . . . 0.0 111.231 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . 0.41 ' HB2' ' HB2' ' A' ' 104' ' ' GLN . 9.0 t-20 -117.12 32.19 6.31 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.255 0.55 . . . . 0.0 110.071 176.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -165.61 -68.54 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.532 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.417 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 2.5 mm -98.19 -101.88 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-O 120.907 0.384 . . . . 0.0 110.382 178.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.417 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 28.9 t0 -153.82 131.86 11.76 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.456 ' HB2' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -56.87 120.13 7.4 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.405 0.44 . . . . 0.0 110.923 -176.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.221 -175.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.602 0 N-CA-C 111.88 -0.488 . . . . 0.0 111.88 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.09 124.81 28.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.742 0.306 . . . . 0.0 110.805 179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.3 mt -102.43 -66.56 0.92 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.941 0.4 . . . . 0.0 110.172 178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.21 158.67 16.16 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.744 178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -135.39 134.92 40.22 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.514 178.208 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -84.91 136.99 33.4 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.067 -177.188 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.91 -14.13 65.11 Favored Glycine 0 N--CA 1.45 -0.374 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.952 -175.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -97.09 -32.39 6.46 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.22 178.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.777 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 97.8 m -95.33 -52.7 4.06 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.477 0.547 . . . . 0.0 112.477 -176.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 68.07 13.06 9.03 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.415 -0.812 . . . . 0.0 110.39 -171.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.777 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 26.3 pt20 -99.19 10.89 40.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.781 -178.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.419 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 0.7 OUTLIER 71.88 134.49 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.393 -179.648 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 8.8 mt -84.57 99.46 6.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.346 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -103.94 9.18 50.92 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.104 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -76.16 -176.97 3.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 111.088 -179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.554 ' HG3' ' H ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -90.12 -27.77 19.41 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.182 -179.108 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -139.89 147.61 40.85 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -177.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.537 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.3 p90 -155.31 -175.63 5.53 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 121.093 0.473 . . . . 0.0 111.87 -177.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.017 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.1 mt -132.31 144.51 50.62 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.009 -178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.907 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.72 149.09 16.32 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 177.374 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.22 -53.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 3.9 mt -40.74 -54.93 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.572 -173.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.421 ' H ' ' H ' ' A' ' 24' ' ' GLN . 35.1 t70 178.82 -12.58 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.798 0.809 . . . . 0.0 108.907 -178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -141.56 179.04 7.04 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.176 179.03 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.907 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.4 m-85 -93.29 154.14 18.17 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.469 179.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -132.04 -165.45 1.59 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.12 -177.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -112.73 170.84 7.91 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.31 173.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.93 -40.25 94.75 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.756 0.312 . . . . 0.0 111.299 -179.247 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -116.64 16.92 15.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.351 -177.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.883 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -90.19 -46.52 8.38 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -177.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 23.0 tp -66.02 110.72 3.04 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.073 0.463 . . . . 0.0 110.42 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.34 -177.8 4.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.767 -178.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.931 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.3 m -55.57 110.49 0.72 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.464 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.571 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 5.9 t70 -77.43 -37.52 51.54 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.348 0.594 . . . . 0.0 109.876 177.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 tp -81.48 -61.71 1.86 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.154 -0.93 . . . . 0.0 111.307 -177.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.5 m -75.7 -61.72 1.83 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.847 -175.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.931 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 122.43 13.29 4.81 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.691 -0.766 . . . . 0.0 113.546 177.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.48 ' N ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -112.51 -98.52 0.42 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.264 0.532 . . . . 0.0 110.886 178.267 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.04 146.99 32.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.966 0.412 . . . . 0.0 110.453 178.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.66 59.4 4.7 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.015 0.436 . . . . 0.0 110.975 -177.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 74.26 40.4 41.34 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.596 -179.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 20.4 mm-40 58.58 -91.58 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.436 0.695 . . . . 0.0 111.698 -179.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.5 t -77.98 129.44 37.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 120.772 0.32 . . . . 0.0 110.278 178.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.506 ' HA3' HD11 ' A' ' 97' ' ' ILE . . . -76.59 90.77 0.95 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.677 -177.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 96' ' ' LEU . 4.3 ttm180 -113.91 -32.16 6.17 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.19 0.519 . . . . 0.0 110.195 179.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -121.64 80.78 1.72 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.395 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.62 106.48 8.76 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.322 0.582 . . . . 0.0 110.552 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.739 ' HD2' ' HD3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -124.28 127.12 47.18 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.481 -0.782 . . . . 0.0 109.39 176.092 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.99 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 9.0 p90 -91.56 144.44 25.54 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.841 -179.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -77.89 169.12 18.83 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.552 -177.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.6 pt? -35.53 -46.96 0.43 Allowed 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 123.875 0.87 . . . . 0.0 113.243 -176.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.482 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -138.59 23.76 2.94 Favored Glycine 0 N--CA 1.447 -0.581 0 C-N-CA 120.443 -0.884 . . . . 0.0 112.31 179.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.426 HH11 ' HD3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -136.94 114.92 11.44 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 122.872 -0.193 . . . . 0.0 110.511 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.99 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.9 pttp -80.64 55.74 2.44 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.453 0.644 . . . . 0.0 110.697 177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.571 ' HA ' ' HB3' ' A' ' 34' ' ' ASP . 0.3 OUTLIER -93.88 176.6 6.28 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.08 -178.824 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.425 ' HB2' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -68.38 156.53 37.64 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.377 -179.496 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.739 ' HD3' ' HD2' ' A' ' 48' ' ' TYR . 4.0 tpt180 -95.31 -45.03 7.32 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.537 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.53 ' HD2' ' HG3' ' A' ' 57' ' ' ARG . 1.1 mmm180 -75.67 -24.24 56.31 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 -177.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.425 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 69.4 m-20 -86.37 -29.1 23.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.191 177.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.535 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -61.46 -33.65 74.12 Favored 'General case' 0 CA--C 1.521 -0.152 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 170.871 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.531 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -61.84 -20.89 64.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.862 -1.063 . . . . 0.0 111.889 -176.106 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.32 -25.71 67.73 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.68 0.276 . . . . 0.0 111.049 177.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -116.41 -38.86 3.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.618 -179.092 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -101.91 -10.32 40.4 Favored Glycine 0 N--CA 1.453 -0.171 0 C-N-CA 120.536 -0.84 . . . . 0.0 113.388 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.531 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -114.26 41.57 2.15 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.484 179.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 1.4 m 28.95 43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 124.025 0.93 . . . . 0.0 113.498 -174.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 25.91 41.91 0.01 OUTLIER Glycine 0 C--N 1.347 1.172 0 N-CA-C 116.119 1.208 . . . . 0.0 116.119 -178.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 58.52 35.87 82.15 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.075 176.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -60.27 -62.77 1.62 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.018 0.437 . . . . 0.0 110.507 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.34 -15.61 21.78 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.01 177.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 106.56 -30.58 9.3 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -174.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -91.85 178.55 5.87 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 114.985 -0.608 . . . . 0.0 110.353 176.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.583 ' HA2' HG22 ' A' ' 83' ' ' THR . . . 178.74 -166.23 35.84 Favored Glycine 0 N--CA 1.447 -0.585 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 179.467 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 89' ' ' PHE . . . 143.76 165.53 10.89 Favored Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.198 -1.001 . . . . 0.0 112.507 179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -94.99 127.09 40.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 177.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 81' ' ' GLU . 15.6 t -72.18 98.66 0.81 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 121.172 0.511 . . . . 0.0 110.869 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 5.9 mtt -82.01 154.36 25.72 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.909 -177.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.42 -15.66 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.011 -0.541 . . . . 0.0 112.335 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -79.53 15.4 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 120.943 0.401 . . . . 0.0 111.213 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.08 39.49 37.31 Favored Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.866 -0.683 . . . . 0.0 111.865 179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 76' ' ' VAL . 0.6 OUTLIER -114.25 99.16 50.4 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.971 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 83' ' ' THR . 69.3 Cg_endo -88.79 -144.81 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 122.888 2.392 . . . . 0.0 112.11 -177.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.583 HG22 ' HA2' ' A' ' 73' ' ' GLY . 0.0 OUTLIER -60.22 116.67 4.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.913 0.387 . . . . 0.0 111.183 179.351 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.485 ' O ' ' HB3' ' A' ' 72' ' ' SER . 1.1 mp -79.41 127.33 31.97 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.081 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.406 ' HA ' ' HB3' ' A' ' 72' ' ' SER . 0.0 OUTLIER -80.67 6.93 11.35 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.659 -175.741 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.2 -0.35 65.66 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.322 178.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 88.11 -1.76 84.94 Favored Glycine 0 N--CA 1.454 -0.163 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.745 179.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -79.42 105.28 10.62 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.929 0.395 . . . . 0.0 110.552 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.54 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 13.8 m-85 -81.99 -165.17 0.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.012 -176.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -83.66 36.68 2.8 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.866 -0.683 . . . . 0.0 113.189 -176.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -93.42 -112.62 0.1 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.855 0.359 . . . . 0.0 110.163 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.1 -67.31 0.02 OUTLIER 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 177.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.43 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 27.1 t70 -140.73 -34.83 0.5 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.887 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.685 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 3.7 tt0 73.9 106.37 0.07 Allowed 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 121.859 0.837 . . . . 0.0 110.92 -177.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -92.18 -145.42 0.21 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.926 -1.033 . . . . 0.0 110.83 -176.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.53 ' HB2' ' H ' ' A' ' 97' ' ' ILE . 0.3 OUTLIER -155.62 -139.31 0.08 Allowed 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.419 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 1.017 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -139.23 136.27 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.824 0 N-CA-C 108.016 -1.105 . . . . 0.0 108.016 170.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -88.8 122.57 32.34 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 121.163 0.506 . . . . 0.0 109.842 -175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.513 HH11 ' HG3' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -81.05 104.62 11.67 Favored 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.979 -178.319 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.537 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 2.4 tp -126.21 -173.7 2.92 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.872 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -133.17 145.94 51.09 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.499 -177.642 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -84.84 -47.41 10.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 120.897 0.379 . . . . 0.0 110.326 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.468 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -83.78 -96.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.98 -178.62 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.468 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.7 OUTLIER -168.33 86.63 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 178.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -131.9 70.52 1.47 Allowed 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.195 0.521 . . . . 0.0 111.429 -175.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.429 ' HB2' ' OE2' ' A' ' 101' ' ' GLU . 6.2 t70 -124.99 -56.5 1.56 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.113 176.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 65.53 31.13 10.31 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.038 -1.437 . . . . 0.0 110.446 -175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 61.1 24.19 14.32 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.931 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -113.1 -5.8 13.71 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.099 -178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -114.51 -75.63 0.66 Allowed Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.647 -0.787 . . . . 0.0 111.936 178.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.2 mp -124.92 -60.73 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-O 121.102 0.477 . . . . 0.0 110.192 178.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -166.44 138.92 3.78 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.637 176.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -71.24 119.0 14.76 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.895 0.379 . . . . 0.0 110.767 -178.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.013 -179.502 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.719 0 N-CA-C 111.916 -0.474 . . . . 0.0 111.916 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -119.39 155.62 31.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.912 0.387 . . . . 0.0 110.972 -179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 mt -83.55 -172.29 4.06 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.876 176.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.816 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -98.01 165.39 11.93 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.844 -179.286 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.37 129.13 34.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.881 177.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -75.85 148.33 38.43 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.116 -179.294 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.02 -17.79 78.81 Favored Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.975 -175.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -91.33 -41.77 5.08 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.692 -0.766 . . . . 0.0 112.31 179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.612 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 64.0 m -92.7 -56.02 3.16 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -178.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 66.82 14.39 9.79 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.997 -169.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.612 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 27.2 pt20 -85.74 12.59 8.63 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.797 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 10.6 t30 74.26 130.01 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 123.978 0.799 . . . . 0.0 111.129 -178.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.816 HD12 ' HB2' ' A' ' 4' ' ' LEU . 7.0 mt -86.18 110.36 19.83 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.335 178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.97 13.55 24.22 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 121.151 -0.547 . . . . 0.0 111.978 -178.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 -71.42 -175.23 1.22 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.842 0.353 . . . . 0.0 110.885 -178.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.586 ' HB2' ' HB2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -95.52 -31.51 13.3 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.237 0.542 . . . . 0.0 110.402 178.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -133.38 159.95 38.81 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.684 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 1.6 p90 -159.02 177.19 11.4 Favored 'General case' 0 C--N 1.324 -0.527 0 C-N-CA 120.114 -0.634 . . . . 0.0 111.906 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.549 ' HB3' HD12 ' A' ' 31' ' ' LEU . 4.7 mt -118.27 137.36 53.1 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.83 -179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.55 145.62 11.22 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.642 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.614 ' HB3' HG22 ' A' ' 97' ' ' ILE . . . 170.36 -44.51 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.64 0.588 . . . . 0.0 111.399 174.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.785 HD13 HD22 ' A' ' 47' ' ' LEU . 1.5 mt -41.8 -52.84 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.092 -174.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.453 ' H ' ' H ' ' A' ' 24' ' ' GLN . 5.3 t70 -174.85 -17.32 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.283 -0.872 . . . . 0.0 109.521 179.505 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.453 ' H ' ' H ' ' A' ' 23' ' ' ASP . 1.5 pm0 -143.76 -172.68 3.79 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.659 -178.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.842 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -95.08 153.5 17.62 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.441 179.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.467 ' HE1' HG13 ' A' ' 22' ' ' ILE . 78.5 m95 -134.74 -165.65 1.7 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.466 0.651 . . . . 0.0 111.184 -177.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.3 m170 -116.18 156.4 26.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.994 -1.003 . . . . 0.0 109.796 177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.18 -33.85 74.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.555 175.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -103.65 2.38 33.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.16 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.986 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 5.6 m -103.21 -50.12 3.56 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.69 -178.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.568 HD21 HD11 ' A' ' 22' ' ' ILE . 0.3 OUTLIER -70.81 98.16 1.51 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.113 0.482 . . . . 0.0 109.912 175.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.504 ' HB3' ' HD3' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -142.91 -172.48 3.67 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.618 -177.021 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.593 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -72.31 107.18 4.78 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 173.534 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -76.41 -29.28 56.99 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.342 -0.845 . . . . 0.0 112.073 -166.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.719 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 15.4 tp -66.59 -43.34 85.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.476 -175.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -110.85 -49.39 3.04 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.397 -176.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 123.83 33.04 0.82 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.283 -0.96 . . . . 0.0 113.541 175.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.438 ' HB2' ' H ' ' A' ' 39' ' ' ARG . 3.0 m -90.35 -111.17 0.08 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.312 0.556 . . . . 0.0 110.126 177.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.504 ' HD3' ' HB3' ' A' ' 32' ' ' SER . 0.3 OUTLIER -178.33 169.33 1.83 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -136.55 147.76 47.21 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 176.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -142.24 -0.57 1.4 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.553 -174.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.935 ' HB2' HD13 ' A' ' 96' ' ' LEU . 1.3 mp0 -86.08 171.69 11.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.926 0.363 . . . . 0.0 110.239 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.756 HG22 ' HA ' ' A' ' 98' ' ' THR . 60.6 t -133.37 138.47 51.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.373 -175.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.4 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . -173.55 5.68 0.03 OUTLIER Glycine 0 CA--C 1.529 0.943 0 C-N-CA 119.227 -1.463 . . . . 0.0 115.372 172.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.586 ' CZ ' ' HG3' ' A' ' 95' ' ' ARG . 9.3 ttm180 176.04 -86.12 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.077 0.939 . . . . 0.0 110.412 175.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.601 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 11.4 ptp180 -163.79 -1.04 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 114.107 1.151 . . . . 0.0 114.107 177.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.785 HD22 HD13 ' A' ' 22' ' ' ILE . 11.3 tp 151.34 142.42 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.169 1.388 . . . . 0.0 108.414 171.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -103.82 90.71 3.71 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.832 -1.147 . . . . 0.0 110.168 170.268 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.778 ' HD2' HD23 ' A' ' 47' ' ' LEU . 24.0 p90 -111.47 170.82 7.86 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.216 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.516 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 0.2 OUTLIER -77.18 160.69 28.77 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.292 -0.413 . . . . 0.0 109.909 178.382 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.49 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -30.86 -45.8 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.281 1.215 . . . . 0.0 114.281 -174.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.49 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -139.23 19.69 3.04 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.217 -0.992 . . . . 0.0 113.543 -177.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.2 ptt-85 -150.56 133.0 15.61 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 117.432 0.616 . . . . 0.0 111.402 176.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.736 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 15.4 pttm -75.02 125.7 29.47 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.407 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.545 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -157.98 175.23 14.1 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 178.834 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.719 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -68.35 164.67 20.34 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 123.265 0.353 . . . . 0.0 110.926 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.508 ' HB2' ' CD1' ' A' ' 48' ' ' TYR . 3.3 tpt180 -106.16 -42.14 5.16 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 120.676 -0.409 . . . . 0.0 111.238 176.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.469 ' H ' ' HG2' ' A' ' 58' ' ' ARG . 10.0 mmt180 -71.07 -33.66 70.45 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.66 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 75.7 m-20 -78.45 -34.68 47.57 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.01 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.545 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -62.6 -38.87 91.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 174.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.675 ' HG ' ' H ' ' A' ' 66' ' ' SER . 0.5 OUTLIER -66.32 -24.49 66.54 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.349 -179.647 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.45 HH12 ' CD ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -66.42 -24.77 66.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.468 -179.352 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.453 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -117.87 -34.61 4.13 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.664 -177.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -122.13 18.51 8.4 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.341 -0.933 . . . . 0.0 113.594 -175.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.545 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -132.36 -112.68 1.41 Allowed Glycine 0 N--CA 1.442 -0.927 0 C-N-CA 120.096 -1.049 . . . . 0.0 111.944 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.675 ' H ' ' HG ' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -138.78 20.67 2.68 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.906 0.384 . . . . 0.0 110.811 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.633 ' HA2' ' HA2' ' A' ' 71' ' ' GLY . . . -82.45 -36.45 16.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 121.225 -0.512 . . . . 0.0 112.554 -179.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -79.14 -25.01 60.35 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.694 -0.765 . . . . 0.0 111.534 178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 -78.53 -65.96 0.92 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.121 0.486 . . . . 0.0 109.905 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.734 ' HB3' ' HA3' ' A' ' 74' ' ' GLY . 0.6 OUTLIER -106.83 -64.02 1.22 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.714 -179.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.633 ' HA2' ' HA2' ' A' ' 67' ' ' GLY . . . 99.61 -126.22 8.84 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.758 -0.735 . . . . 0.0 111.995 179.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.82 70.46 6.35 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.012 0.434 . . . . 0.0 110.14 177.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 100.79 -70.31 0.44 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.622 -0.799 . . . . 0.0 111.324 -174.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.734 ' HA3' ' HB3' ' A' ' 70' ' ' MET . . . 87.13 -106.24 3.14 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.169 174.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -113.68 135.11 54.29 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 120.902 0.382 . . . . 0.0 110.631 -178.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.45 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 17.4 t -70.6 108.51 2.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.146 178.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.593 ' HG3' ' HA ' ' A' ' 82' ' ' PRO . 5.9 mtt -64.95 154.7 36.79 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.853 -176.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 3.9 m -61.65 -7.39 1.81 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.135 -178.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.62 -14.62 15.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.149 0.499 . . . . 0.0 110.307 176.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 110.83 -5.39 29.2 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.182 178.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.401 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.4 pt-20 -156.95 148.99 17.52 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.364 -0.235 . . . . 0.0 110.364 179.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.593 ' HA ' ' HG3' ' A' ' 77' ' ' MET . 2.7 Cg_exo -75.77 -139.58 0.02 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.332 0 C-N-CA 123.123 2.549 . . . . 0.0 111.236 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.453 HG21 ' HZ ' ' A' ' 89' ' ' PHE . 2.2 p -77.56 -100.12 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 174.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.571 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -119.68 172.83 7.4 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 171.324 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.66 -46.6 81.76 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 174.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.81 69.24 0.72 Allowed Glycine 0 N--CA 1.445 -0.746 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 166.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -72.36 13.99 2.57 Favored Glycine 0 C--N 1.33 0.224 0 N-CA-C 114.271 0.468 . . . . 0.0 114.271 -170.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.45 ' CD ' HH12 ' A' ' 62' ' ' ARG . 20.3 mt-10 -91.91 73.43 5.66 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.571 ' HD1' HD11 ' A' ' 84' ' ' LEU . 0.0 OUTLIER -63.75 -178.29 0.29 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.773 -174.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.51 -92.33 2.09 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 111.191 -0.764 . . . . 0.0 111.191 175.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.582 ' OD2' ' HB2' ' A' ' 95' ' ' ARG . 0.8 OUTLIER -122.13 -80.19 0.62 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.876 0.37 . . . . 0.0 110.086 177.765 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -121.06 -48.13 2.25 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.08 176.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.482 ' O ' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -141.09 10.88 2.17 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.931 0.396 . . . . 0.0 110.632 177.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.821 ' HB3' HD12 ' A' ' 96' ' ' LEU . 10.9 mt-10 81.58 104.86 0.06 Allowed 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.486 1.114 . . . . 0.0 110.991 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.586 ' HG3' ' CZ ' ' A' ' 45' ' ' ARG . 1.7 ttm180 -76.87 -0.65 24.87 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.474 -1.239 . . . . 0.0 112.149 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.935 HD13 ' HB2' ' A' ' 42' ' ' GLU . 0.7 OUTLIER -32.02 154.67 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.946 1.832 . . . . 0.0 115.946 -171.738 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.646 ' O ' ' HA ' ' A' ' 43' ' ' VAL . 0.1 OUTLIER -67.53 -152.97 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.279 178.425 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.756 ' HA ' HG22 ' A' ' 43' ' ' VAL . 6.2 t -152.8 152.64 31.84 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.28 175.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 3.8 mmm180 -103.48 123.54 47.09 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.547 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -117.05 174.21 6.23 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.191 0.52 . . . . 0.0 110.611 -178.095 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.5 137.44 38.91 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.79 178.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 43.6 t-20 -92.61 -47.7 6.98 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 174.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.509 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.3 OUTLIER -108.45 -94.68 0.4 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.095 173.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.509 ' H ' ' HB ' ' A' ' 103' ' ' THR . 3.6 pt20 -164.07 59.46 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 121.069 0.462 . . . . 0.0 111.045 177.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.586 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -125.38 80.88 1.92 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.069 0.462 . . . . 0.0 110.967 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.92 -50.66 10.82 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.174 -177.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -85.88 20.17 2.3 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.75 -177.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -86.73 5.13 37.79 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.476 0.655 . . . . 0.0 110.186 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -86.18 36.75 0.69 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.31 -179.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 91.2 17.97 48.3 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.571 -0.823 . . . . 0.0 112.418 178.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.548 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -105.66 -106.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 177.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.548 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 25.2 t70 -172.72 104.79 0.15 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.424 175.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.491 ' HB3' ' HE1' ' A' ' 105' ' ' PHE . 1.4 t70 -107.68 169.79 8.38 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.141 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.806 -178.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.764 0 N-CA-C 112.164 -0.375 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.3 -38.44 65.86 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.258 0.551 . . . . 0.0 110.695 -178.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.613 HD21 HG23 ' A' ' 103' ' ' THR . 1.1 mp -108.93 -142.3 0.38 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.923 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.677 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -69.11 163.67 24.26 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.059 -179.336 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -122.45 132.85 54.54 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 172.753 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.47 134.0 33.67 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.229 -174.18 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.7 -4.65 76.63 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.302 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.466 ' O ' ' HB ' ' A' ' 43' ' ' VAL . . . -84.7 -55.05 2.77 Favored Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.431 179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.513 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -108.52 -26.58 10.36 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.929 -0.308 . . . . 0.0 111.523 -178.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 66.32 21.39 10.97 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.578 -179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.9 pt20 -91.82 10.94 26.46 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.091 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.4 OUTLIER 74.55 141.26 0.07 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.854 179.721 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.677 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.7 mt -97.26 110.22 24.73 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.764 -178.214 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -118.1 18.59 11.28 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 121.072 -0.585 . . . . 0.0 111.808 -179.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 15.8 m-20 -76.99 -172.84 2.48 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.072 0.463 . . . . 0.0 111.49 -177.242 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.503 ' HB2' ' HA ' ' A' ' 105' ' ' PHE . 1.2 ptp180 -99.9 -24.26 14.71 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 173.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.424 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -141.21 142.72 33.95 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -175.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.795 ' HA ' ' HG3' ' A' ' 28' ' ' GLU . 0.3 OUTLIER -160.35 -171.54 3.21 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.967 0.413 . . . . 0.0 111.606 -176.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.426 HD12 ' HA ' ' A' ' 28' ' ' GLU . 10.7 mt -125.19 140.93 52.42 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.107 -179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.816 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.43 135.21 6.69 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 172.513 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.531 ' HB3' HG12 ' A' ' 97' ' ' ILE . . . 175.06 -45.82 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.741 HG13 HD11 ' A' ' 97' ' ' ILE . 73.0 mt -47.56 -46.63 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 112.836 0.68 . . . . 0.0 112.836 -170.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.437 ' HB3' ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 175.28 -11.16 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 -177.226 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.661 HE22 ' HG3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -149.3 -177.91 6.1 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.37 174.448 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.816 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.1 m-85 -87.83 155.11 20.04 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.52 ' HZ2' ' HB2' ' A' ' 46' ' ' ARG . 87.2 m95 -137.12 -162.43 1.29 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.825 0.821 . . . . 0.0 112.137 -175.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.2 m80 -125.43 162.56 24.56 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 113.953 -1.476 . . . . 0.0 109.242 175.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.795 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 50.0 mt-10 -69.0 -40.76 78.53 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 120.816 0.341 . . . . 0.0 110.902 177.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -103.72 -8.51 19.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.826 -172.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.906 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.2 m -73.06 -43.42 61.95 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.482 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.717 HD22 HD23 ' A' ' 47' ' ' LEU . 94.8 mt -78.52 111.11 14.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.543 176.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.662 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 0.7 OUTLIER -149.37 -112.72 0.06 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 179.105 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.608 ' O ' ' HB2' ' A' ' 40' ' ' LEU . 0.8 OUTLIER -95.99 113.04 24.62 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 122.436 0.294 . . . . 0.0 111.098 -177.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.549 ' OD1' ' HB3' ' A' ' 40' ' ' LEU . 3.8 t0 -95.9 -41.08 8.98 Favored 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.316 -179.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 3.3 tp -62.72 -48.44 79.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.182 0.515 . . . . 0.0 110.076 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 11.6 m -75.93 -23.09 55.42 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.097 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 64.26 36.62 93.45 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.92 176.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 13.0 m -63.52 -72.09 0.15 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.74 -34.72 9.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.882 0.372 . . . . 0.0 110.025 173.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.662 ' CD1' ' H ' ' A' ' 32' ' ' SER . 15.3 mt -75.67 -128.28 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.805 177.278 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.481 ' H ' ' HB3' ' A' ' 40' ' ' LEU . . . 93.38 49.61 2.55 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 110.711 -0.956 . . . . 0.0 110.711 -176.239 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.506 ' HA ' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER 51.85 71.07 0.48 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.305 0.574 . . . . 0.0 111.532 -176.096 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.466 ' HB ' ' O ' ' A' ' 8' ' ' GLY . 1.8 m -86.54 6.49 2.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.67 -0.696 . . . . 0.0 112.345 -175.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 45' ' ' ARG . . . 156.88 6.15 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 118.414 -1.85 . . . . 0.0 115.749 168.106 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.475 ' HB2' ' O ' ' A' ' 44' ' ' GLY . 0.0 OUTLIER 171.17 -78.64 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 118.81 1.305 . . . . 0.0 113.66 175.478 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.829 ' HA ' ' HE3' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -126.73 -169.87 2.1 Favored 'General case' 0 N--CA 1.465 0.304 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -164.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.848 HD22 ' H ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER 176.77 -173.87 0.11 Allowed 'General case' 0 N--CA 1.463 0.186 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -174.231 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.848 ' H ' HD22 ' A' ' 47' ' ' LEU . 2.1 t80 -77.71 92.13 4.13 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 105.804 -1.925 . . . . 0.0 105.804 166.251 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.845 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 16.3 p90 -128.08 149.96 50.16 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.9 -164.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.676 ' HE2' ' CE1' ' A' ' 60' ' ' TYR . 4.1 mmtt -77.7 170.2 16.98 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.583 -178.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.588 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -29.74 -62.07 0.14 Allowed 'General case' 0 N--CA 1.474 0.74 0 O-C-N 124.488 1.117 . . . . 0.0 112.103 -177.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -131.31 20.14 4.74 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.01 177.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.9 mtt85 -132.55 111.54 11.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.096 0.474 . . . . 0.0 111.076 -178.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.845 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -86.52 110.93 20.11 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.678 179.029 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.039 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 1.5 pt? -156.76 164.43 38.12 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.791 0.329 . . . . 0.0 111.239 -179.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -70.89 154.58 41.7 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.03 -0.986 . . . . 0.0 112.371 -172.287 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.699 HH21 ' HB3' ' A' ' 91' ' ' ASP . 1.2 tpp180 -63.14 -61.38 2.42 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -174.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.01 -35.73 81.35 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.591 0.71 . . . . 0.0 110.333 -175.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.476 ' OD1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -73.39 -31.72 64.06 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 114.101 -1.408 . . . . 0.0 109.645 -174.933 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.676 ' CE1' ' HE2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -67.36 -40.85 85.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.902 173.246 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.618 ' HA ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -72.42 -15.07 61.83 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.358 -177.46 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -73.48 -22.24 60.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.061 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.425 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.1 OUTLIER -120.89 -49.19 2.22 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 -177.858 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -132.49 33.53 2.64 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.242 -0.98 . . . . 0.0 113.322 -174.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.618 ' HA3' ' HA ' ' A' ' 61' ' ' LEU . . . -76.92 -83.81 0.49 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.109 -1.043 . . . . 0.0 111.317 176.565 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.515 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.0 OUTLIER -101.68 -120.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 173.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.515 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -115.44 -1.52 21.69 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.436 -0.887 . . . . 0.0 112.091 176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.52 -119.97 6.32 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.544 -177.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.7 m-70 59.59 -99.55 0.1 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 122.658 0.383 . . . . 0.0 111.57 176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 9.5 mtt -83.82 -21.38 32.11 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.994 0.425 . . . . 0.0 110.655 -179.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 88.97 96.54 1.04 Allowed Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.958 -179.291 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -129.01 126.8 40.3 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.101 0.477 . . . . 0.0 110.609 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.646 ' HA3' ' HD1' ' A' ' 89' ' ' PHE . . . 177.31 177.8 46.48 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.163 -0.775 . . . . 0.0 111.163 -178.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.447 ' O ' ' HA ' ' A' ' 82' ' ' PRO . . . 112.61 172.3 18.66 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.708 -177.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -146.52 130.56 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.847 0.356 . . . . 0.0 110.838 -177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.547 HG23 HD11 ' A' ' 84' ' ' LEU . 48.2 t -87.52 112.89 24.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.805 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.462 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -55.8 153.0 8.89 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.098 -176.299 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.462 ' HB ' ' O ' ' A' ' 77' ' ' MET . 76.1 t 75.62 -55.83 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.856 178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 2.5 t -76.64 -35.19 24.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.998 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 75.96 49.07 9.04 Favored Glycine 0 N--CA 1.445 -0.764 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.595 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.433 ' HB2' ' HB ' ' A' ' 76' ' ' VAL . 1.8 mt-10 -106.11 106.67 57.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-O 120.786 0.327 . . . . 0.0 110.259 -178.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HA ' ' O ' ' A' ' 74' ' ' GLY . 84.9 Cg_endo -88.5 -172.59 0.76 Allowed 'Trans proline' 0 N--CA 1.458 -0.618 0 C-N-CA 122.731 2.287 . . . . 0.0 112.99 -175.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 45.26 63.8 1.63 Allowed 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 174.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.547 HD11 HG23 ' A' ' 76' ' ' VAL . 0.5 OUTLIER -84.5 147.42 27.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.393 177.066 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -15.93 62.81 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.868 -175.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -64.36 -27.6 71.89 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.868 -0.682 . . . . 0.0 112.516 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 81.33 10.09 85.09 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.489 178.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.66 86.06 5.45 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 178.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.646 ' HD1' ' HA3' ' A' ' 73' ' ' GLY . 0.0 OUTLIER -73.16 143.37 47.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.149 0.5 . . . . 0.0 110.502 -179.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 175.84 109.31 0.24 Allowed Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.232 -0.895 . . . . 0.0 111.109 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.699 ' HB3' HH21 ' A' ' 57' ' ' ARG . 1.0 OUTLIER -78.21 -92.02 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 117.481 0.64 . . . . 0.0 110.798 -178.032 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -124.6 -52.41 1.7 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.275 0.56 . . . . 0.0 109.95 178.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -140.92 25.24 2.14 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.12 177.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.552 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 2.8 mm-40 60.16 40.26 18.43 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.764 -170.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.684 ' HA ' ' HB2' ' A' ' 48' ' ' TYR . 1.0 OUTLIER -161.63 163.56 29.86 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.747 -172.637 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.408 HD21 ' HA ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -87.84 20.12 3.2 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 122.356 1.074 . . . . 0.0 109.078 174.654 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.741 HD11 HG13 ' A' ' 22' ' ' ILE . 4.7 mt -112.6 166.36 6.69 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.703 -1.135 . . . . 0.0 111.635 -175.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.516 ' N ' HG22 ' A' ' 97' ' ' ILE . 4.0 t -117.22 152.2 35.31 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.145 173.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.424 ' HB3' ' CE2' ' A' ' 17' ' ' TYR . 39.3 mmm-85 -81.26 109.48 15.82 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.59 176.48 5.1 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.148 0.499 . . . . 0.0 111.208 -176.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -99.2 129.9 45.47 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.227 -0.897 . . . . 0.0 109.819 176.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.554 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 39.5 t30 -76.91 -87.84 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.665 -177.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.613 HG23 HD21 ' A' ' 3' ' ' LEU . 1.2 m -78.36 -81.11 0.1 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 109.913 -0.402 . . . . 0.0 109.913 177.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.62 -67.68 0.12 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.074 174.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.503 ' HA ' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -177.14 127.97 0.16 Allowed 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 -178.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.34 -42.15 90.8 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -178.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.933 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . . . -94.11 58.6 2.55 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.216 172.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -71.37 -15.13 62.36 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.338 -178.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 24.9 t30 -64.84 -35.12 80.09 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.607 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.91 -147.13 20.3 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 121.009 -0.615 . . . . 0.0 111.749 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -110.18 -38.54 3.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.04 0.447 . . . . 0.0 110.412 178.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -106.02 162.26 13.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.924 176.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.933 ' HA ' ' HB3' ' A' ' 107' ' ' ALA . 4.1 t0 -85.09 99.39 11.02 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.239 0.542 . . . . 0.0 110.853 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.311 -0.852 . . . . 0.0 109.226 178.306 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.275 -0.73 . . . . 0.0 111.275 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.65 155.85 36.8 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.785 0.326 . . . . 0.0 110.769 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mt -77.38 -177.64 4.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.556 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.758 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -108.31 158.86 17.1 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.676 -0.238 . . . . 0.0 110.419 179.821 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.6 127.72 47.8 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.888 0.375 . . . . 0.0 110.681 175.777 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -79.83 138.03 37.11 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.423 -176.568 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.69 -7.56 88.12 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.928 -0.653 . . . . 0.0 112.409 -177.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -83.44 -55.51 2.86 Favored Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.394 -179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.732 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 19.3 p -111.86 -25.88 9.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.779 0.289 . . . . 0.0 111.37 -177.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 66.89 23.64 9.89 Favored 'General case' 0 N--CA 1.465 0.298 0 O-C-N 123.688 0.617 . . . . 0.0 112.064 178.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.732 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 2.2 pt20 -86.05 7.8 23.18 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.515 0.191 . . . . 0.0 111.515 179.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.469 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 11.1 t30 74.66 134.82 0.05 Allowed 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.158 0.583 . . . . 0.0 110.783 -177.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.758 HD12 ' HB2' ' A' ' 4' ' ' LEU . 3.5 mt -93.22 102.75 13.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -116.64 17.38 13.69 Favored Glycine 0 N--CA 1.449 -0.445 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.846 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -77.86 -174.05 3.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.571 -0.315 . . . . 0.0 110.819 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.447 ' HB2' ' HB2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -95.11 -25.66 16.34 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.606 176.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -132.78 146.07 51.53 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.615 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.6 p90 -154.56 175.77 13.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.319 0.58 . . . . 0.0 112.11 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.721 ' HB3' HD12 ' A' ' 31' ' ' LEU . 6.5 mt -125.37 140.8 52.49 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.379 -178.408 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.968 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.4 145.2 11.26 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 176.498 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 174.98 -45.0 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.555 0 O-C-N 123.181 0.3 . . . . 0.0 111.611 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.625 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 3.8 mt -46.42 -48.16 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.841 -173.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 25.1 t70 172.86 -14.73 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.535 -0.757 . . . . 0.0 109.105 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.26 176.77 8.41 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.565 176.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.968 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.63 153.76 20.86 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.625 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 71.6 m95 -135.89 -165.64 1.74 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.728 -176.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.2 m80 -117.12 169.92 9.06 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.981 173.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.456 ' HG2' ' HA ' ' A' ' 18' ' ' PHE . 1.6 mm-40 -68.02 -38.03 82.09 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-O 120.76 0.314 . . . . 0.0 111.327 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -101.75 -16.52 16.61 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-O 121.15 0.5 . . . . 0.0 111.243 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.874 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 7.0 m -72.65 -49.29 32.77 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.058 -178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.721 HD12 ' HB3' ' A' ' 19' ' ' LEU . 0.4 OUTLIER -54.87 103.03 0.08 Allowed 'General case' 0 C--N 1.326 -0.416 0 O-C-N 123.836 0.71 . . . . 0.0 111.698 -178.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -148.82 161.03 42.65 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.569 177.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.951 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 11.6 t -62.24 146.88 49.67 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.862 0.363 . . . . 0.0 110.199 178.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -59.72 -32.89 70.96 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.049 -178.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 tp -105.52 -44.01 4.8 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.651 -175.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.951 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 55.3 m -58.47 -53.36 59.2 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.223 0.535 . . . . 0.0 110.209 177.482 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 68.1 22.35 74.22 Favored Glycine 0 CA--C 1.519 0.334 0 CA-C-N 115.267 -0.879 . . . . 0.0 113.109 177.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.627 ' SG ' ' HB3' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -86.64 -98.48 0.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.828 0.314 . . . . 0.0 110.745 -179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -172.59 110.04 0.22 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.617 0.246 . . . . 0.0 110.958 -179.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.33 -9.61 59.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.139 0.495 . . . . 0.0 110.056 175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.438 ' HA3' ' O ' ' A' ' 28' ' ' GLU . . . -81.88 -6.68 88.77 Favored Glycine 0 N--CA 1.449 -0.448 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.675 174.675 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -97.94 -67.13 0.86 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -102.56 100.03 9.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.12 172.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -162.53 74.21 0.19 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 120.473 -0.87 . . . . 0.0 112.463 -173.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.451 ' HG3' ' N ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -88.13 -26.21 22.59 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.48 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.596 ' HB2' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -136.21 -173.64 3.45 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.663 175.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.84 ' HB2' HG12 ' A' ' 97' ' ' ILE . 1.0 OUTLIER -161.28 127.8 3.92 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.951 0.405 . . . . 0.0 110.845 178.708 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.705 ' HE1' ' HG2' ' A' ' 92' ' ' GLU . 80.1 t80 -122.42 134.97 54.59 Favored 'General case' 0 N--CA 1.442 -0.873 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.341 174.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.871 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 8.1 p90 -143.68 156.9 44.69 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 174.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' CB ' ' HG3' ' A' ' 53' ' ' ARG . 0.3 OUTLIER -80.32 151.94 29.24 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -39.66 -35.57 0.33 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.57 10.84 6.39 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.255 -0.974 . . . . 0.0 113.095 -178.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.437 ' HG3' ' CB ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -145.97 126.98 14.58 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 117.28 0.54 . . . . 0.0 110.996 178.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.871 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -81.91 64.9 6.8 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.278 0.561 . . . . 0.0 110.962 179.079 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.563 HD21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -125.43 150.09 47.61 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 176.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.673 ' SG ' ' HG2' ' A' ' 58' ' ' ARG . 25.5 p -66.74 175.44 2.39 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.799 0.809 . . . . 0.0 112.355 -172.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.659 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 18.4 tpt180 -75.17 -29.27 60.36 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.552 -1.203 . . . . 0.0 110.545 177.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.673 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.33 -44.24 46.39 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.554 -178.192 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.42 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 54.1 m-20 -66.3 -46.38 77.15 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.079 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.563 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -58.96 -38.4 78.99 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.17 176.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.74 HD11 ' HA3' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -61.85 -30.31 70.76 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.225 -179.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.506 ' HD3' ' HA ' ' A' ' 62' ' ' ARG . 0.1 OUTLIER -83.61 -21.48 32.54 Favored 'General case' 0 N--CA 1.445 -0.715 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -175.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.427 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -104.34 -60.64 1.56 Allowed 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.693 -0.403 . . . . 0.0 111.605 178.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -94.62 -38.41 4.99 Favored Glycine 0 N--CA 1.454 -0.111 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.307 -179.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.598 ' HA2' ' HA ' ' A' ' 61' ' ' LEU . . . 26.15 42.99 0.02 OUTLIER Glycine 0 N--CA 1.467 0.733 0 N-CA-C 116.261 1.264 . . . . 0.0 116.261 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -64.09 -42.25 97.01 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.041 0.448 . . . . 0.0 110.445 177.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -87.29 7.79 79.38 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.958 177.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.74 ' HA3' HD11 ' A' ' 61' ' ' LEU . . . -94.02 -60.36 1.13 Allowed Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 175.265 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.58 -85.33 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.267 0.627 . . . . 0.0 111.942 175.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.587 ' O ' ' HG3' ' A' ' 77' ' ' MET . 5.2 mtm -68.53 -54.84 14.17 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 177.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.409 ' HA3' ' SD ' ' A' ' 77' ' ' MET . . . 90.99 -76.43 1.52 Allowed Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.969 -0.634 . . . . 0.0 113.022 176.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -76.25 71.58 2.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.912 0.387 . . . . 0.0 110.944 -178.308 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.446 ' H ' ' HA2' ' A' ' 87' ' ' GLY . . . 69.36 -107.02 1.96 Allowed Glycine 0 N--CA 1.448 -0.541 0 N-CA-C 111.429 -0.669 . . . . 0.0 111.429 -177.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -106.29 -15.86 16.43 Favored Glycine 0 N--CA 1.447 -0.607 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 174.522 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.39 119.92 20.92 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.911 0.386 . . . . 0.0 110.482 178.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.562 HG13 ' HA ' ' A' ' 70' ' ' MET . 2.3 t -75.35 123.86 32.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.524 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.607 ' HB3' ' HB3' ' A' ' 81' ' ' GLU . 3.1 mtm -64.93 159.8 22.03 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.469 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.525 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -90.04 -123.89 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.648 179.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.525 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 1.4 t -111.82 -16.86 8.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.971 0.415 . . . . 0.0 110.921 -178.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.13 67.81 0.22 Allowed Glycine 0 N--CA 1.447 -0.603 0 N-CA-C 110.936 -0.865 . . . . 0.0 110.936 177.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.607 ' HB3' ' HB3' ' A' ' 77' ' ' MET . 0.0 OUTLIER -108.27 104.77 54.95 Favored Pre-proline 0 C--N 1.323 -0.576 0 CA-C-O 121.068 0.461 . . . . 0.0 111.905 -172.545 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -98.23 -152.38 0.03 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.851 0 C-N-CA 123.534 2.822 . . . . 0.0 111.885 178.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -78.07 85.66 4.27 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 173.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.9 156.1 15.12 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.831 -173.441 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.36 -40.02 95.03 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.841 176.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.45 -135.17 7.74 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 172.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.446 ' HA2' ' H ' ' A' ' 73' ' ' GLY . . . 53.04 56.08 20.73 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 121.068 -0.587 . . . . 0.0 112.553 177.138 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -79.52 83.65 5.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.904 0.383 . . . . 0.0 110.459 -178.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -65.28 159.43 23.87 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.421 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -112.11 -118.07 3.63 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.941 -0.647 . . . . 0.0 111.711 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -151.43 -115.33 0.04 OUTLIER 'General case' 0 N--CA 1.434 -1.228 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 -177.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.705 ' HG2' ' HE1' ' A' ' 48' ' ' TYR . 8.7 pt-20 -166.52 -54.47 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 175.071 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.561 ' H ' ' HG3' ' A' ' 92' ' ' GLU . 11.8 t70 -140.72 -41.8 0.4 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.998 174.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.596 ' OE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER 68.8 161.75 0.2 Allowed 'General case' 0 N--CA 1.467 0.398 0 O-C-N 124.011 0.819 . . . . 0.0 111.846 177.762 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.514 ' HB2' ' HE1' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -120.37 -16.84 8.35 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.554 -177.605 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.418 ' HA ' ' N ' ' A' ' 47' ' ' LEU . 1.8 mp 61.38 -171.14 0.15 Allowed 'General case' 0 N--CA 1.467 0.421 0 O-C-N 123.378 0.424 . . . . 0.0 110.815 -177.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.84 HG12 ' HB2' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -155.44 136.77 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.556 0 CA-C-O 120.965 0.412 . . . . 0.0 110.131 175.54 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -120.18 128.62 53.57 Favored 'General case' 0 N--CA 1.432 -1.369 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 177.109 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.557 ' HD2' HD21 ' A' ' 19' ' ' LEU . 2.0 mmm-85 -79.28 103.02 8.92 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.794 HD13 ' HE2' ' A' ' 20' ' ' LYS . 0.3 OUTLIER -88.03 164.66 15.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-O 121.545 0.688 . . . . 0.0 111.137 -174.558 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.478 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -100.13 127.62 46.34 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 114.139 -1.391 . . . . 0.0 109.392 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -89.09 179.28 6.18 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.674 -175.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 87.8 m -51.21 -51.3 55.15 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.055 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -51.14 -40.79 59.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.085 -177.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.447 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 0.1 OUTLIER -138.1 87.9 2.28 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.786 0.327 . . . . 0.0 110.814 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.738 ' HB3' ' HA ' ' A' ' 112' ' ' ASP . 9.3 t70 -99.72 -113.11 0.17 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.614 178.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 61.44 29.63 18.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.77 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -106.66 -82.41 0.54 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.548 -0.297 . . . . 0.0 110.713 178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -83.49 -34.38 25.37 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 176.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -104.42 170.24 18.21 Favored Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.627 175.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.455 ' O ' ' HB3' ' A' ' 112' ' ' ASP . 1.2 mm -92.15 56.1 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 178.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.738 ' HA ' ' HB3' ' A' ' 106' ' ' ASP . 12.7 t70 75.01 -58.47 0.57 Allowed 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.969 -176.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -85.03 90.99 7.97 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.573 177.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 . . . . . 0 C--O 1.247 0.952 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.152 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.76 0 N-CA-C 112.194 -0.363 . . . . 0.0 112.194 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.2 m -90.99 136.69 32.91 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 122.905 -0.173 . . . . 0.0 110.574 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.0 mt -73.2 -105.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.095 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.554 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -133.51 160.63 36.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.528 0.204 . . . . 0.0 110.579 -178.8 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.624 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.6 OUTLIER -136.28 136.55 39.89 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.411 177.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.72 150.05 21.79 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 116.477 -0.329 . . . . 0.0 110.208 -177.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -64.91 -16.32 61.54 Favored Glycine 0 N--CA 1.452 -0.3 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.424 -177.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -109.19 -13.85 16.45 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 120.888 -0.672 . . . . 0.0 112.034 177.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.468 ' C ' ' H ' ' A' ' 11' ' ' GLN . 1.7 m -143.53 90.7 2.18 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 121.579 0.704 . . . . 0.0 110.487 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -75.76 18.19 0.26 Allowed 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.224 174.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.468 ' H ' ' C ' ' A' ' 9' ' ' CYS . 1.2 pt20 -79.27 3.68 17.32 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.429 176.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' LEU . 3.3 t-20 80.22 132.46 0.05 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.341 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.554 HD12 ' HB2' ' A' ' 4' ' ' LEU . 8.2 mt -82.04 113.08 20.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.036 177.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.23 10.32 26.71 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.347 -176.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.8 m-20 -85.85 176.08 8.3 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.498 ' HB2' ' CD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -83.73 -29.75 27.24 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.509 -175.254 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.6 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -131.46 154.09 49.07 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 -178.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.629 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.8 p90 -159.56 172.79 17.18 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.168 0.509 . . . . 0.0 111.359 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.581 HD22 HG22 ' A' ' 97' ' ' ILE . 7.8 mt -119.04 136.44 54.13 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.251 178.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.992 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.0 154.05 17.06 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.542 -178.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.592 ' HB3' ' C ' ' A' ' 96' ' ' LEU . . . 163.38 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.72 0.637 . . . . 0.0 112.615 169.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 84.2 mt -51.05 -36.9 16.52 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.233 -176.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 11.4 t70 168.42 -17.92 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 176.313 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.71 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.68 -166.18 1.6 Allowed 'General case' 0 N--CA 1.443 -0.822 0 CA-C-N 113.693 -1.594 . . . . 0.0 109.356 -176.317 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.992 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 7.2 m-85 -111.53 160.57 17.04 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 175.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.495 ' HD1' ' HA ' ' A' ' 20' ' ' LYS . 67.4 m95 -139.1 -173.67 3.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.973 0.416 . . . . 0.0 110.157 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 20.9 m80 -105.38 151.67 23.91 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 107.246 -1.39 . . . . 0.0 107.246 168.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.07 -50.66 70.38 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.845 0.355 . . . . 0.0 111.439 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -92.64 14.04 18.2 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.763 0.315 . . . . 0.0 111.392 -179.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.793 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.0 OUTLIER -92.84 -36.23 12.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.325 179.016 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.484 HD23 ' HA ' ' A' ' 31' ' ' LEU . 5.4 mt -75.31 64.64 1.53 Allowed 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.883 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.556 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 0.0 OUTLIER -111.04 170.3 8.19 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.632 -176.661 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 40' ' ' LEU . 1.6 m -68.05 161.15 27.37 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.622 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' A' ' 55' ' ' LEU . 1.5 t70 -91.94 -51.13 5.35 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.079 179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.695 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 15.4 tp -91.03 -49.48 6.39 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.093 -178.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.887 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 10.5 m -58.72 -44.32 90.39 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 120.936 0.398 . . . . 0.0 110.914 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 80.09 18.3 72.41 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.198 174.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -95.47 -105.87 0.15 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 117.071 0.435 . . . . 0.0 109.894 177.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -155.44 38.37 0.39 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.674 0.273 . . . . 0.0 110.375 177.419 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.468 ' HA ' ' SG ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER 57.12 -105.16 0.25 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.585 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.463 ' H ' ' HB3' ' A' ' 40' ' ' LEU . . . -95.23 2.17 65.37 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.349 179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.8 OUTLIER 70.97 -61.92 0.47 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.822 0.849 . . . . 0.0 111.539 -179.866 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.433 HG23 ' HG2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -96.59 174.24 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.071 176.313 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -82.13 52.37 4.62 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.936 -0.649 . . . . 0.0 112.234 178.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.433 ' HG2' HG23 ' A' ' 43' ' ' VAL . 1.8 ptp180 -91.52 -69.47 0.74 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 179.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -135.31 131.11 36.08 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 175.459 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.459 ' HB2' HG12 ' A' ' 97' ' ' ILE . 0.2 OUTLIER -139.93 123.73 17.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.222 0.534 . . . . 0.0 110.981 -177.164 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.479 ' CE2' ' HB3' ' A' ' 94' ' ' GLU . 21.9 m-85 -100.28 154.82 18.17 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.371 176.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.562 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.3 OUTLIER -160.57 139.01 10.08 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.218 0.533 . . . . 0.0 110.156 174.497 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HB3' HD22 ' A' ' 51' ' ' LEU . 4.4 mmtt -81.47 170.75 15.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.592 -179.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.825 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.57 -46.79 0.14 Allowed 'General case' 0 N--CA 1.476 0.871 0 O-C-N 123.91 0.756 . . . . 0.0 112.865 -176.392 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -144.13 22.2 2.09 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.288 -0.958 . . . . 0.0 112.983 179.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.06 127.26 19.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 117.044 0.422 . . . . 0.0 111.177 179.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -78.69 117.48 19.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.002 179.383 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.555 HD11 ' HB2' ' A' ' 60' ' ' TYR . 1.1 pt? -161.21 156.5 24.3 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.611 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 28.3 p -80.79 -175.83 5.52 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.541 0.686 . . . . 0.0 111.546 -176.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' A' ' 61' ' ' LEU . 9.8 tpt180 -85.87 -10.81 54.73 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.225 176.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.84 -40.77 10.45 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.344 -176.467 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.887 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.3 OUTLIER -87.3 -18.36 30.34 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.338 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.611 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -71.99 -31.51 66.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.447 -0.797 . . . . 0.0 108.996 167.274 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.81 HD21 ' HA3' ' A' ' 73' ' ' GLY . 6.9 tp -64.9 -16.46 63.27 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.62 -178.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.31 -25.15 64.98 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.108 0.48 . . . . 0.0 110.592 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.4 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -117.3 -46.37 2.7 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.672 -177.286 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.29 3.59 58.18 Favored Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.959 -176.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.552 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -134.23 42.79 1.32 Allowed Glycine 0 N--CA 1.45 -0.412 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -67.91 42.41 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -63.43 -34.79 90.91 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.619 -0.593 . . . . 0.0 111.619 176.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 112.62 -28.67 8.79 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.477 -0.868 . . . . 0.0 113.425 173.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.432 ' CE1' ' HB2' ' A' ' 72' ' ' SER . 0.2 OUTLIER -124.45 164.01 20.61 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.548 0.689 . . . . 0.0 111.675 -176.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 1.9 mtt -78.99 -22.57 45.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.444 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.14 -36.81 72.1 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.14 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.432 ' HB2' ' CE1' ' A' ' 69' ' ' HIS . 11.9 m -142.37 103.39 4.26 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.763 0.316 . . . . 0.0 110.53 178.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.81 ' HA3' HD21 ' A' ' 61' ' ' LEU . . . -73.14 -29.01 65.22 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.241 -0.981 . . . . 0.0 111.903 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 76.79 25.26 65.21 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.604 176.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 82' ' ' PRO . 6.2 t70 -78.37 95.83 5.17 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.2 p -127.95 110.68 22.47 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.489 0.662 . . . . 0.0 110.955 -175.196 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 3.6 mtt -80.86 103.57 10.78 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.972 179.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.439 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 2.0 t 53.96 -108.53 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.227 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.831 -176.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.439 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 0.0 OUTLIER -129.52 33.49 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.153 0.501 . . . . 0.0 110.208 177.772 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.42 -2.08 87.16 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 113.139 -177.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.424 ' HA ' ' HD2' ' A' ' 82' ' ' PRO . 4.2 mt-10 58.31 96.84 0.04 OUTLIER Pre-proline 0 N--CA 1.469 0.477 0 C-N-CA 122.839 0.455 . . . . 0.0 111.635 179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.554 ' HB3' ' O ' ' A' ' 75' ' ' ASP . 18.8 Cg_endo -63.32 162.17 28.0 Favored 'Trans proline' 0 C--O 1.235 0.367 0 C-N-CA 122.986 2.457 . . . . 0.0 113.445 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -79.81 71.1 6.46 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.401 175.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 11.3 mt -67.99 99.29 0.84 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.974 -174.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -131.72 34.58 3.88 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.355 -178.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 80.64 59.89 2.42 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.332 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 83.63 -42.92 3.09 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 121.003 -0.617 . . . . 0.0 112.87 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.24 81.82 8.26 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.89 0.376 . . . . 0.0 111.902 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.9 -175.7 5.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.384 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -176.13 102.45 0.17 Allowed Glycine 0 N--CA 1.447 -0.633 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 4.2 p-10 -67.56 -92.45 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -171.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.491 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -159.02 -34.6 0.06 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.069 0.461 . . . . 0.0 110.476 -176.416 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 95' ' ' ARG . 7.0 t0 -87.99 14.91 8.02 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.468 -176.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.479 ' HB3' ' CE2' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -79.94 32.86 0.26 Allowed 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.638 0.732 . . . . 0.0 110.987 176.625 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.508 ' H ' ' HG3' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -110.14 -138.09 0.37 Allowed 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.135 -177.851 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.84 ' HB3' ' HA ' ' A' ' 22' ' ' ILE . 0.4 OUTLIER 56.74 55.04 6.63 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 171.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.581 HG22 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -150.84 132.01 4.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 121.564 0.697 . . . . 0.0 111.947 169.057 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -139.94 139.08 36.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.367 175.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.6 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 0.0 OUTLIER -88.19 113.59 23.96 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 178.227 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.629 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.8 OUTLIER -118.51 175.27 5.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.359 0.6 . . . . 0.0 111.478 -175.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -115.95 145.74 42.67 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.155 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -54.86 -57.85 9.95 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.107 0.48 . . . . 0.0 110.821 -178.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 3.7 t -124.41 -127.44 0.25 Allowed 'General case' 0 N--CA 1.442 -0.847 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 14.3 mt-30 -112.53 63.51 0.63 Allowed 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.498 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -85.48 70.92 10.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.14 -178.188 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -90.98 -81.92 0.3 Allowed 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.033 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.527 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . 57.03 35.28 26.2 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.156 -178.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -78.83 125.65 29.65 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.543 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -66.97 -16.92 64.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.217 -179.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -52.99 -40.71 58.62 Favored Glycine 0 C--N 1.335 0.475 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 176.037 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.407 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 0.4 OUTLIER -109.34 -89.9 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.198 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.407 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 2.7 t0 -173.95 174.68 2.96 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.065 -0.97 . . . . 0.0 108.997 171.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.527 ' HA ' ' HA ' ' A' ' 107' ' ' ALA . 1.5 t70 -81.88 114.21 20.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.892 0.377 . . . . 0.0 110.276 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.906 -0.568 . . . . 0.0 110.071 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.626 0 N-CA-C 111.836 -0.505 . . . . 0.0 111.836 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.33 167.55 11.92 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.849 0.357 . . . . 0.0 110.637 -179.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.431 ' HB2' ' ND2' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -100.97 -173.91 2.49 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 176.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.453 ' HB3' ' CD2' ' A' ' 25' ' ' TYR . 0.4 OUTLIER -87.31 159.42 18.78 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.2 177.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.428 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -126.18 135.27 51.44 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.75 178.562 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.582 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -86.33 139.09 31.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.856 -177.395 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -73.68 -11.39 80.58 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 121.09 -0.576 . . . . 0.0 112.692 -176.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -100.56 -30.64 6.11 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.206 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.887 ' HB3' ' HG2' ' A' ' 11' ' ' GLN . 78.3 m -103.09 -49.85 3.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.587 0.232 . . . . 0.0 111.442 -179.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 65.35 15.93 10.27 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.131 -176.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.887 ' HG2' ' HB3' ' A' ' 9' ' ' CYS . 18.2 pt20 -101.51 21.92 13.5 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.855 -179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.431 ' ND2' ' HB2' ' A' ' 3' ' ' LEU . 1.1 t30 71.19 129.01 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.674 179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.41 HG23 ' CD2' ' A' ' 27' ' ' HIS . 8.0 mt -86.92 102.11 11.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.773 178.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.99 11.66 44.98 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.98 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -69.86 179.58 2.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.985 0.421 . . . . 0.0 110.657 -178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -91.88 -30.82 15.95 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.756 -179.911 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -122.29 159.66 26.94 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 175.323 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.591 ' O ' HD22 ' A' ' 19' ' ' LEU . 3.7 p90 -160.27 159.77 31.78 Favored 'General case' 0 CA--C 1.503 -0.86 0 CA-C-O 121.652 0.739 . . . . 0.0 110.378 178.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.591 HD22 ' O ' ' A' ' 18' ' ' PHE . 3.3 mm? -125.35 141.52 52.02 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 114.463 -1.244 . . . . 0.0 109.911 -175.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.015 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.38 145.62 13.19 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 -176.773 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . 178.66 -43.96 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.518 0 O-C-N 123.319 0.387 . . . . 0.0 111.999 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.822 HG12 HD13 ' A' ' 47' ' ' LEU . 3.5 mt -48.2 -38.84 8.55 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 116.024 -0.535 . . . . 0.0 112.306 -174.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.479 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 0.6 OUTLIER 167.37 -18.35 0.0 OUTLIER 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 121.764 0.792 . . . . 0.0 109.14 178.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.473 HE21 ' HZ2' ' A' ' 26' ' ' TRP . 1.4 pm0 -134.72 -172.39 3.02 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.489 -1.232 . . . . 0.0 109.463 -178.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 1.015 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.9 m-85 -98.18 155.65 17.06 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.26 -0.427 . . . . 0.0 109.892 177.127 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.499 ' HB2' ' HB2' ' A' ' 31' ' ' LEU . 82.6 m95 -141.22 -167.45 2.4 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.408 0.623 . . . . 0.0 110.488 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.769 ' HB2' ' SG ' ' A' ' 30' ' ' CYS . 13.7 m80 -113.24 178.74 4.18 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.265 173.163 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -65.15 -52.16 56.79 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 120.831 0.348 . . . . 0.0 111.269 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -90.35 8.03 35.54 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.382 0.611 . . . . 0.0 110.849 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.769 ' SG ' ' HB2' ' A' ' 27' ' ' HIS . 53.2 m -98.83 -53.24 3.34 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.383 178.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.71 HD23 HD11 ' A' ' 40' ' ' LEU . 0.5 OUTLIER -84.87 71.4 10.89 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.351 172.633 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.611 ' C ' HD13 ' A' ' 40' ' ' LEU . 3.6 m -128.23 -111.87 0.27 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.042 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.925 ' HB3' ' HB2' ' A' ' 36' ' ' CYS . 4.6 t -122.79 167.91 12.91 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.432 ' HB2' ' O ' ' A' ' 40' ' ' LEU . 50.0 t0 -94.97 -61.11 1.54 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.891 -1.05 . . . . 0.0 109.914 170.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' CG ' ' A' ' 59' ' ' ASP . 33.9 tp -63.03 -36.54 83.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.598 -176.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.925 ' HB2' ' HB3' ' A' ' 33' ' ' CYS . 33.3 m -64.81 -15.45 61.77 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 120.67 0.272 . . . . 0.0 111.088 178.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 98.04 10.75 51.36 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.825 -0.702 . . . . 0.0 113.48 172.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.538 ' CB ' ' HB2' ' A' ' 32' ' ' SER . 2.0 m -81.54 -75.3 0.29 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.885 0.343 . . . . 0.0 111.46 -178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.458 ' HB3' ' H ' ' A' ' 40' ' ' LEU . 15.5 ttm-85 -159.37 -99.23 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.12 178.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.821 HD23 ' HB3' ' A' ' 54' ' ' LYS . 1.2 mp 32.85 84.36 0.02 OUTLIER 'General case' 0 C--N 1.346 0.427 0 N-CA-C 113.724 1.009 . . . . 0.0 113.724 178.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -130.87 -98.26 0.78 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.399 -0.905 . . . . 0.0 111.964 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.43 ' OE1' ' HH2' ' A' ' 26' ' ' TRP . 0.0 OUTLIER 4.19 -98.52 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.673 1.589 . . . . 0.0 114.758 177.767 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.603 HG22 ' H ' ' A' ' 44' ' ' GLY . 2.9 p -152.62 176.54 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-O 120.725 0.298 . . . . 0.0 111.563 -174.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.603 ' H ' HG22 ' A' ' 43' ' ' VAL . . . -170.25 -173.2 37.39 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.18 -0.533 . . . . 0.0 112.227 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 ttm-85 -148.97 -67.37 0.22 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.844 0.322 . . . . 0.0 111.055 178.184 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 84.63 3.32 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 -178.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.822 HD13 HG12 ' A' ' 22' ' ' ILE . 0.6 OUTLIER 176.95 142.83 0.08 Allowed 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 178.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 57.4 t80 -80.96 96.38 7.07 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-O 121.373 0.606 . . . . 0.0 111.085 -179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 1.017 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 35.3 p90 -123.15 160.83 25.66 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 170.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -81.15 165.48 21.52 Favored 'General case' 0 C--N 1.316 -0.851 0 C-N-CA 121.143 -0.223 . . . . 0.0 111.182 -174.424 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.51 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.34 -62.18 0.08 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.675 1.19 . . . . 0.0 112.841 -176.826 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.482 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -135.86 31.54 2.63 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.77 -0.728 . . . . 0.0 111.945 177.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.71 112.86 4.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 1.017 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 2.2 mtmm -78.25 69.85 4.52 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.148 0.499 . . . . 0.0 111.083 -177.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.503 HD22 ' HB2' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -99.33 173.18 6.9 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.035 -0.53 . . . . 0.0 109.646 178.381 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 22.4 p -91.49 169.63 10.61 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-O 121.999 0.904 . . . . 0.0 111.97 -175.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.45 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 6.4 tpt180 -77.18 -2.31 33.82 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.245 -1.343 . . . . 0.0 110.033 176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 7.5 mmt85 -100.67 -50.66 3.81 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.45 -175.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.487 ' O ' ' HB2' ' A' ' 62' ' ' ARG . 33.2 p30 -74.16 -22.73 59.31 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.14 -0.624 . . . . 0.0 110.503 178.659 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -70.01 -33.88 72.59 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 173.234 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.714 HD13 ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -66.01 -19.3 65.81 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.96 178.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.664 ' NH2' ' HA ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -66.95 -27.96 67.89 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.931 178.03 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -118.45 -60.17 1.81 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.343 -176.524 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -91.06 22.19 30.38 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.963 -0.637 . . . . 0.0 113.058 -177.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.714 ' HA3' HD13 ' A' ' 61' ' ' LEU . . . -104.63 -107.56 3.22 Favored Glycine 0 N--CA 1.441 -0.973 0 C-N-CA 120.393 -0.908 . . . . 0.0 111.816 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -108.93 -102.66 0.37 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.811 0.338 . . . . 0.0 110.741 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -100.23 -19.14 19.73 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.827 -0.701 . . . . 0.0 111.954 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA2' ' HA ' ' A' ' 62' ' ' ARG . . . 125.29 -15.59 7.24 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.118 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -61.9 -177.27 0.11 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.331 0.586 . . . . 0.0 111.75 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.664 ' HA ' ' NH2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.49 -74.84 0.45 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.482 178.588 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.481 ' HA3' ' HA3' ' A' ' 86' ' ' GLY . . . 69.14 -59.5 0.57 Allowed Glycine 0 CA--C 1.523 0.546 0 CA-C-N 116.144 -0.48 . . . . 0.0 113.016 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.649 ' N ' ' H ' ' A' ' 87' ' ' GLY . 1.4 m 61.34 96.38 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.591 0.756 . . . . 0.0 112.287 178.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.891 ' HA3' ' H ' ' A' ' 85' ' ' MET . . . 146.11 -93.69 0.16 Allowed Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.597 -0.811 . . . . 0.0 113.574 174.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 1.002 ' HA2' ' HG2' ' A' ' 88' ' ' GLU . . . 170.42 -137.82 4.65 Favored Glycine 0 N--CA 1.442 -0.943 0 N-CA-C 110.828 -0.909 . . . . 0.0 110.828 -177.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -82.68 141.7 32.25 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 174.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -78.52 94.9 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 121.069 0.461 . . . . 0.0 110.702 -178.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.14 173.79 7.48 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.702 179.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.476 HG23 HG22 ' A' ' 79' ' ' VAL . 35.0 m -70.93 -18.94 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.148 0.499 . . . . 0.0 110.183 175.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.476 HG22 HG23 ' A' ' 78' ' ' VAL . 0.0 OUTLIER -113.82 25.02 4.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.716 175.417 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.5 ' HA2' HD12 ' A' ' 84' ' ' LEU . . . -66.93 -52.5 32.7 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.26 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.756 ' HB3' ' HD2' ' A' ' 82' ' ' PRO . 65.7 mm-40 61.93 174.62 0.06 OUTLIER Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 122.52 0.328 . . . . 0.0 111.07 177.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.756 ' HD2' ' HB3' ' A' ' 81' ' ' GLU . 15.5 Cg_exo -40.44 -54.32 2.31 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 123.347 2.698 . . . . 0.0 113.828 -177.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -46.37 -47.11 18.77 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.043 -0.98 . . . . 0.0 113.099 -177.004 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.684 ' HA ' ' HA3' ' A' ' 73' ' ' GLY . 19.3 mt -102.16 102.82 13.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.803 0.335 . . . . 0.0 111.899 -175.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.891 ' H ' ' HA3' ' A' ' 73' ' ' GLY . 12.0 ttp -126.19 -46.18 1.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.889 179.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.481 ' HA3' ' HA3' ' A' ' 71' ' ' GLY . . . -148.79 -80.53 0.03 OUTLIER Glycine 0 C--N 1.338 0.687 0 C-N-CA 120.022 -1.085 . . . . 0.0 114.354 -175.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.649 ' H ' ' N ' ' A' ' 72' ' ' SER . . . -56.65 107.57 0.95 Allowed Glycine 0 C--O 1.223 -0.548 0 N-CA-C 112.475 -0.25 . . . . 0.0 112.475 -175.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 1.002 ' HG2' ' HA2' ' A' ' 74' ' ' GLY . 0.9 OUTLIER -72.22 109.61 6.09 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 113.069 0.766 . . . . 0.0 113.069 -171.114 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.5 OUTLIER -106.26 159.7 15.92 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 169.405 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 178.47 57.79 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.082 -1.056 . . . . 0.0 113.088 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -115.98 -87.87 0.59 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.215 0.531 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 93' ' ' ASP . 1.1 pt-20 -137.76 -75.37 0.4 Allowed 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.278 177.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.775 ' HB3' ' HB3' ' A' ' 96' ' ' LEU . 2.4 t0 -140.99 26.24 2.05 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.571 175.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.426 ' HG3' ' C ' ' A' ' 93' ' ' ASP . 0.1 OUTLIER 36.81 -108.32 0.05 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.261 1.024 . . . . 0.0 111.7 -176.213 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.526 HH21 ' HA ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -90.57 81.49 5.9 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 173.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.775 ' HB3' ' HB3' ' A' ' 93' ' ' ASP . 0.2 OUTLIER -75.21 113.3 12.41 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.465 179.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.516 ' CG2' HD13 ' A' ' 31' ' ' LEU . 0.0 OUTLIER -146.12 125.67 5.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.207 0.527 . . . . 0.0 111.784 -179.293 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -98.73 108.36 21.03 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.21 -0.905 . . . . 0.0 109.748 173.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.581 ' HA ' ' CD2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -70.39 92.04 0.79 Allowed 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 179.674 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.451 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -99.03 169.09 9.67 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.755 0.788 . . . . 0.0 111.645 -170.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.405 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -106.7 138.87 42.07 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 114.398 -1.274 . . . . 0.0 109.855 -179.275 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -75.66 149.17 38.23 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.3 m -61.4 -51.09 70.22 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.158 0.504 . . . . 0.0 110.043 177.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 16.8 mm100 -82.66 54.15 2.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.375 -0.829 . . . . 0.0 109.891 173.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.631 ' CD1' ' HB2' ' A' ' 16' ' ' ARG . 9.8 t80 -58.37 -63.94 1.1 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.429 -177.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.978 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 33.3 t70 48.74 -83.59 0.01 OUTLIER 'General case' 0 C--O 1.234 0.26 0 C-N-CA 124.537 1.135 . . . . 0.0 112.413 176.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 66.09 29.43 9.94 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 113.713 -1.585 . . . . 0.0 111.321 -179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -123.07 -48.72 1.98 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.803 176.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 43.5 t30 -98.7 -36.01 9.99 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.336 173.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 141.1 -117.89 1.3 Allowed Glycine 0 N--CA 1.444 -0.781 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.407 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.409 ' H ' HG13 ' A' ' 111' ' ' ILE . 0.9 OUTLIER -83.05 1.83 3.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.572 0.701 . . . . 0.0 110.196 176.635 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -94.15 78.42 4.02 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.25 178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.978 ' HA ' ' HB2' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -55.42 139.42 43.43 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.695 -179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.269 178.774 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.615 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -111.25 159.02 18.31 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.608 0.204 . . . . 0.0 110.705 -179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.13 -109.72 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.911 0.386 . . . . 0.0 110.766 -179.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.761 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.2 OUTLIER -111.32 160.71 16.77 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.765 0.317 . . . . 0.0 110.264 177.072 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.88 130.01 37.22 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.446 176.145 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.585 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.24 144.94 27.82 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.65 -175.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.483 ' HA2' ' NE2' ' A' ' 10' ' ' GLN . . . -82.66 -3.39 90.53 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.862 ' HA2' ' HE2' ' A' ' 54' ' ' LYS . . . -88.5 -46.55 4.59 Favored Glycine 0 N--CA 1.447 -0.622 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.608 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.627 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.9 p -121.04 -30.31 4.39 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 121.136 -0.226 . . . . 0.0 111.53 -179.005 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA2' ' A' ' 7' ' ' GLY . 0.0 OUTLIER 66.33 25.27 10.46 Favored 'General case' 0 CA--C 1.531 0.214 0 O-C-N 123.659 0.599 . . . . 0.0 112.059 179.696 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 1.3 pt20 -82.69 4.86 23.25 Favored 'General case' 0 C--N 1.331 -0.204 0 O-C-N 122.399 -0.188 . . . . 0.0 111.218 177.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 2.6 t30 76.5 135.79 0.06 Allowed 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.387 -175.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.761 HD12 ' HB2' ' A' ' 4' ' ' LEU . 4.1 mt -91.93 107.5 18.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.597 -178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.57 2.89 27.74 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.053 -179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -71.9 178.15 3.86 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 178.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.534 ' HB2' ' CD1' ' A' ' 105' ' ' PHE . 4.3 ptt180 -90.27 -29.6 18.04 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.792 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.494 ' CE2' ' HB3' ' A' ' 99' ' ' ARG . 0.3 OUTLIER -124.16 141.47 52.03 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.961 -179.805 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.695 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 3.2 p90 -151.56 176.02 11.74 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.008 0.433 . . . . 0.0 111.18 -179.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.915 HD22 ' HB ' ' A' ' 97' ' ' ILE . 6.6 mt -118.62 139.76 50.99 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.158 -179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.948 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.96 147.36 14.9 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 177.482 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.493 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 170.86 -40.02 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.489 0.493 . . . . 0.0 111.786 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.552 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 17.6 mt -52.99 -52.67 26.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.986 -172.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.436 ' H ' ' H ' ' A' ' 24' ' ' GLN . 8.0 t0 -174.54 -18.54 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.816 0.817 . . . . 0.0 109.18 -177.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.436 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -146.92 -177.17 5.52 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.25 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.948 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 2.3 m-85 -86.36 152.37 22.78 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 177.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.552 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 78.4 m95 -132.26 -167.89 1.96 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.331 0.586 . . . . 0.0 110.352 -177.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m170 -117.33 159.25 23.03 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 114.795 -1.093 . . . . 0.0 108.627 173.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.603 ' HA ' HD12 ' A' ' 19' ' ' LEU . 4.3 mt-10 -63.5 -36.89 85.26 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.101 0.25 . . . . 0.0 111.614 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.48 ' HA ' ' HD3' ' A' ' 39' ' ' ARG . 6.9 t70 -115.97 6.35 14.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.101 0.476 . . . . 0.0 112.185 -175.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.903 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.53 -38.33 17.32 Favored 'General case' 0 C--N 1.321 -0.65 0 O-C-N 122.227 -0.296 . . . . 0.0 111.52 -178.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -58.84 95.76 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.382 -176.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -151.43 155.32 38.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 1.041 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -68.13 168.13 12.74 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.142 0.496 . . . . 0.0 111.815 -176.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -76.91 -46.1 25.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.508 175.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.692 HD23 ' HB2' ' A' ' 59' ' ' ASP . 22.1 tp -70.1 -62.15 1.5 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.514 -176.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.755 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -87.08 -63.83 1.24 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 179.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 71.15 59.18 5.16 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.516 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.06 -83.23 0.15 Allowed 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 110.252 -0.277 . . . . 0.0 110.252 177.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.48 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.8 OUTLIER -178.14 114.46 0.08 Allowed 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.497 177.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.4 ' HA ' ' NH2' ' A' ' 46' ' ' ARG . 0.2 OUTLIER -116.21 74.51 0.9 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 174.861 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -127.52 45.69 1.13 Allowed Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.366 -0.921 . . . . 0.0 113.196 -173.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.513 ' OE2' ' HB3' ' A' ' 45' ' ' ARG . 0.8 OUTLIER -95.88 -157.87 0.61 Allowed 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 176.332 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -127.26 7.29 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.261 177.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.23 79.69 0.03 OUTLIER Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.293 -0.956 . . . . 0.0 112.857 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.561 ' O ' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -158.31 -93.76 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.171 0.485 . . . . 0.0 110.451 178.601 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.496 ' HG3' ' CG ' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -103.34 69.11 0.99 Allowed 'General case' 0 C--N 1.321 -0.669 0 O-C-N 122.188 -0.32 . . . . 0.0 110.874 -179.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.773 ' HG ' HG12 ' A' ' 97' ' ' ILE . 1.1 tm? -117.89 117.02 28.14 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.035 0.445 . . . . 0.0 110.055 175.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.717 ' HE1' ' HA ' ' A' ' 91' ' ' ASP . 0.3 OUTLIER -138.68 161.57 36.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.722 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -160.68 143.77 13.2 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.923 0.392 . . . . 0.0 110.45 178.006 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.592 ' HB2' HD22 ' A' ' 55' ' ' LEU . 2.8 mmtt -81.73 170.14 16.11 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.976 -177.248 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -33.88 -46.95 0.24 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.876 1.065 . . . . 0.0 113.876 -177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -143.52 20.76 2.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 119.96 -1.114 . . . . 0.0 113.54 -178.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.81 150.97 32.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.365 0.582 . . . . 0.0 111.445 178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.862 ' HE2' ' HA2' ' A' ' 8' ' ' GLY . 0.0 OUTLIER -80.89 127.12 32.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 178.056 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.041 ' HA ' ' HB3' ' A' ' 33' ' ' CYS . 0.3 OUTLIER -160.37 158.93 30.47 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 178.963 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.53 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 29.5 p -87.72 178.64 6.68 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 120.015 -0.674 . . . . 0.0 110.805 -179.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.479 ' HG2' ' HB3' ' A' ' 89' ' ' PHE . 7.1 tpt180 -84.04 -6.46 59.41 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.45 177.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.459 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -90.23 -50.9 5.72 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 177.263 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.755 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -75.83 -15.46 60.23 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.118 179.572 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.578 ' CE2' HD13 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -73.88 -40.15 63.41 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 169.451 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.834 HD12 ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -73.05 -20.06 61.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.778 178.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.554 ' HB2' ' HA ' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.54 -30.7 71.07 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.215 -179.288 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.411 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -121.68 -47.96 2.18 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.527 -0.306 . . . . 0.0 111.54 -178.312 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.35 20.35 46.89 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.535 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.834 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -122.32 -89.17 0.96 Allowed Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.78 177.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.491 ' HB2' ' H ' ' A' ' 67' ' ' GLY . 0.8 OUTLIER -90.2 -121.06 0.06 Allowed 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 176.322 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.491 ' H ' ' HB2' ' A' ' 66' ' ' SER . . . -123.79 -54.79 0.19 Allowed Glycine 0 N--CA 1.447 -0.616 0 C-N-CA 120.415 -0.898 . . . . 0.0 112.347 178.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -148.86 -6.24 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.539 -179.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -79.07 -145.75 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.239 0.542 . . . . 0.0 111.398 -178.475 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.47 -66.64 0.89 Allowed 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.183 -176.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.522 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . 112.92 -39.52 2.83 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.985 -0.846 . . . . 0.0 110.985 -174.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.514 ' HA ' ' CZ ' ' A' ' 89' ' ' PHE . 51.7 m -70.29 104.41 2.66 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.09 128.58 9.13 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.496 -0.859 . . . . 0.0 112.558 -174.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 99.26 -74.03 0.51 Allowed Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.309 -0.716 . . . . 0.0 111.309 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -147.28 160.55 42.37 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 173.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -84.87 149.67 4.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 175.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.774 ' HA ' ' HG3' ' A' ' 82' ' ' PRO . 40.2 mtp -67.56 97.87 0.63 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.9 0.381 . . . . 0.0 110.719 -176.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 1.3 p -123.2 -17.93 4.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.352 -178.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -104.29 13.78 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.403 177.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.453 ' HA2' ' HD3' ' A' ' 45' ' ' ARG . . . 84.45 -57.62 5.02 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.75 -0.659 . . . . 0.0 112.34 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -129.36 87.76 52.55 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.026 0.441 . . . . 0.0 111.304 -178.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.774 ' HG3' ' HA ' ' A' ' 77' ' ' MET . 92.3 Cg_endo -95.74 -161.44 0.07 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.979 0 C-N-CA 123.339 2.692 . . . . 0.0 111.571 178.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.02 140.45 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.236 -0.283 . . . . 0.0 110.236 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.602 HD22 ' CD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -111.66 102.4 10.72 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.543 -175.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.82 7.94 44.59 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.437 0.637 . . . . 0.0 110.65 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -138.91 -96.69 0.36 Allowed Glycine 0 N--CA 1.447 -0.6 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.634 ' HA3' HD21 ' A' ' 61' ' ' LEU . . . -72.54 121.48 8.07 Favored Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.53 -0.843 . . . . 0.0 111.404 173.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -84.88 84.47 7.69 Favored 'General case' 0 C--N 1.318 -0.781 0 O-C-N 122.413 -0.463 . . . . 0.0 109.905 -178.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.602 ' CD2' HD22 ' A' ' 84' ' ' LEU . 0.1 OUTLIER -69.72 153.79 42.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.136 -174.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 93' ' ' ASP . . . -127.38 87.74 0.33 Allowed Glycine 0 N--CA 1.442 -0.96 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 174.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.717 ' HA ' ' HE1' ' A' ' 48' ' ' TYR . 11.6 p-10 -58.76 -63.06 1.43 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.297 0.57 . . . . 0.0 111.286 -176.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.7 OUTLIER -78.97 -24.47 43.83 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.22 178.192 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.488 ' HB3' ' HA3' ' A' ' 90' ' ' GLY . 20.9 t70 -67.7 -27.49 66.87 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.904 -179.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -78.56 -102.43 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.99 179.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.412 ' HB3' ' CD1' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.0 160.99 36.93 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.025 0.44 . . . . 0.0 110.936 -176.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -121.36 -176.09 3.22 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.915 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.68 135.37 14.42 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.591 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 176.262 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -111.44 128.86 56.12 Favored 'General case' 0 N--CA 1.435 -1.194 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.096 -176.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HG3' ' HG ' ' A' ' 19' ' ' LEU . 1.2 mtt180 -87.46 106.52 18.03 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 116.113 -0.494 . . . . 0.0 109.719 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.695 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -104.32 173.9 6.1 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.411 -0.813 . . . . 0.0 111.973 -173.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.652 ' HB3' ' HZ ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -103.18 127.65 50.41 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.242 -1.345 . . . . 0.0 110.089 177.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -70.91 -75.25 0.13 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.196 -177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 1.3 m -109.21 -121.94 0.26 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.323 -176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -139.84 84.79 2.0 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.652 ' HZ ' ' HB3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -53.41 -83.71 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.171 -175.221 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -110.3 -70.94 0.78 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.95 0.405 . . . . 0.0 110.059 178.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -104.11 -35.54 8.02 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.405 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 64.99 -69.48 0.1 Allowed 'General case' 0 N--CA 1.47 0.555 0 O-C-N 124.025 0.828 . . . . 0.0 112.045 178.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 27.1 t30 -93.33 3.42 55.64 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.169 0.509 . . . . 0.0 110.346 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -100.44 167.3 20.1 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 121.019 -0.61 . . . . 0.0 111.867 179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -87.52 -27.89 5.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 121.017 0.437 . . . . 0.0 110.258 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -88.95 56.91 3.9 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.657 178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -89.2 116.61 27.57 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.906 178.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.495 -176.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.469 ' HA2' ' HA3' ' A' ' 14' ' ' GLY . . . . . . . . 0 N--CA 1.483 1.788 0 N-CA-C 111.912 -0.475 . . . . 0.0 111.912 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.8 m -85.18 178.37 7.54 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.718 0.259 . . . . 0.0 110.684 178.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.58 -25.96 67.64 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 -175.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.417 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.9 OUTLIER -67.23 151.05 48.22 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.248 0.547 . . . . 0.0 110.95 -178.446 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.55 134.09 46.74 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.483 177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.621 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -95.32 148.61 22.24 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.112 -177.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.69 -3.05 77.97 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.564 -177.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.488 ' HA3' ' HB3' ' A' ' 30' ' ' CYS . . . -88.31 -17.82 56.57 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.342 -179.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.401 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 30.1 p -143.51 -38.45 0.33 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.765 0.317 . . . . 0.0 110.844 178.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 69.93 25.77 4.84 Favored 'General case' 0 N--CA 1.46 0.074 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.282 -178.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -95.67 14.49 22.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.842 179.121 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 3.2 m120 74.25 136.73 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.199 0.6 . . . . 0.0 110.739 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.417 HD12 ' HB2' ' A' ' 4' ' ' LEU . 9.0 mt -87.51 107.92 17.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 121.163 0.506 . . . . 0.0 110.946 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.469 ' HA3' ' HA2' ' A' ' 1' ' ' GLY . . . -117.01 12.74 14.45 Favored Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 179.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.66 -172.44 1.24 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.306 0.574 . . . . 0.0 110.993 -178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.642 ' HD2' ' HB2' ' A' ' 17' ' ' TYR . 0.3 OUTLIER -96.61 -23.01 16.7 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.25 175.81 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.883 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -139.1 152.54 47.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.736 -178.011 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -156.9 176.12 13.18 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.468 0.652 . . . . 0.0 111.509 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.616 HD22 ' HB ' ' A' ' 97' ' ' ILE . 19.1 mt -121.87 150.55 41.79 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.854 178.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.749 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.88 143.95 11.41 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 176.346 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.61 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -176.23 -65.35 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.773 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 18.6 mt -36.83 -50.6 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.876 0.87 . . . . 0.0 112.995 -172.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.462 ' H ' ' H ' ' A' ' 24' ' ' GLN . 38.4 t70 176.5 -12.56 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.057 0.932 . . . . 0.0 108.977 178.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.773 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.1 OUTLIER -128.77 -167.08 1.72 Allowed 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.185 -1.37 . . . . 0.0 109.409 -176.148 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.749 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 m-85 -111.96 159.74 18.12 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 175.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.51 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 90.7 m95 -135.53 -165.29 1.67 Allowed 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 121.468 0.652 . . . . 0.0 110.719 -175.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m80 -121.77 -173.7 2.71 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 114.672 -1.149 . . . . 0.0 108.928 176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -80.07 -47.57 14.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.696 0.284 . . . . 0.0 110.809 178.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -109.08 1.92 20.8 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.865 -0.607 . . . . 0.0 112.129 -172.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.742 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.4 m -80.68 -44.78 18.22 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.934 -177.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.466 ' HB3' HD11 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -55.67 110.3 0.69 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.013 -177.032 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -128.07 164.01 23.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.985 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.566 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 1.7 t -68.1 163.15 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.59 179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.03 -27.32 18.71 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.481 -1.236 . . . . 0.0 109.063 169.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.6 tp -99.26 -56.69 2.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.267 -0.879 . . . . 0.0 112.084 -176.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 86.9 m -56.26 -49.86 72.98 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 121.206 0.527 . . . . 0.0 110.436 -178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.02 -33.21 5.19 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.336 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.556 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 0.5 OUTLIER -70.23 -73.77 0.16 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.761 0.315 . . . . 0.0 110.445 -179.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.556 ' HD3' ' O ' ' A' ' 38' ' ' CYS . 0.0 OUTLIER -158.9 -146.79 0.15 Allowed 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.517 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.812 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 53.0 mt -96.67 111.62 23.7 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 175.507 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -88.84 -43.23 5.48 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.688 -174.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.967 ' HG3' ' HG2' ' A' ' 58' ' ' ARG . 10.7 mm-40 -106.33 11.75 30.64 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.047 0.451 . . . . 0.0 110.648 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.812 ' HB ' ' HB3' ' A' ' 40' ' ' LEU . 81.5 t -117.84 96.2 4.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-N 115.651 -0.704 . . . . 0.0 109.788 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.78 7.01 25.87 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.246 -0.978 . . . . 0.0 112.402 -177.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.79 -33.02 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 122.502 0.321 . . . . 0.0 110.5 174.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HB2' ' CE1' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -106.84 122.44 46.4 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.503 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.56 HD22 ' HB3' ' A' ' 49' ' ' TYR . 0.4 OUTLIER -95.81 113.88 25.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.896 -178.549 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.559 ' CE1' ' HB2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -107.05 91.4 3.64 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 172.544 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.771 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 4.7 p90 -111.96 158.63 19.28 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.777 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.82 149.33 26.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 174.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.851 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -32.58 -51.5 0.28 Allowed 'General case' 0 N--CA 1.476 0.86 0 O-C-N 123.939 0.774 . . . . 0.0 112.956 -173.819 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -120.19 19.67 9.29 Favored Glycine 0 N--CA 1.449 -0.452 0 C-N-CA 120.501 -0.857 . . . . 0.0 113.007 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.72 109.35 8.0 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.615 0.208 . . . . 0.0 110.728 178.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.771 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.81 108.4 16.81 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 176.371 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.566 ' HB2' ' SG ' ' A' ' 33' ' ' CYS . 0.4 OUTLIER -147.81 175.54 10.85 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.274 -175.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.723 ' HB3' ' HB2' ' A' ' 42' ' ' GLU . 3.2 m -78.88 170.68 16.3 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 120.969 0.414 . . . . 0.0 110.721 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -58.03 -43.91 87.03 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.475 179.394 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.967 ' HG2' ' HG3' ' A' ' 42' ' ' GLU . 9.2 mmt180 -64.86 -45.05 87.66 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.806 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -68.89 -31.29 70.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.375 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.459 ' HB2' HD21 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -66.59 -39.52 88.46 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.548 176.505 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.516 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.9 OUTLIER -78.54 0.02 27.8 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.578 177.963 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.59 -21.76 23.87 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.063 0.458 . . . . 0.0 110.544 178.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -117.96 -51.2 2.46 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.612 178.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -99.32 37.9 3.33 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.471 176.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -140.93 43.32 1.12 Allowed Glycine 0 N--CA 1.444 -0.777 0 N-CA-C 111.734 -0.546 . . . . 0.0 111.734 -176.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.42 41.29 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -173.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -111.26 -34.67 2.08 Favored Glycine 0 N--CA 1.447 -0.626 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 174.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.61 5.7 88.2 Favored Glycine 0 C--N 1.331 0.292 0 C-N-CA 121.329 -0.463 . . . . 0.0 112.965 176.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.454 ' HB3' ' H ' ' A' ' 70' ' ' MET . 8.6 m170 -120.53 -159.84 0.81 Allowed 'General case' 0 C--N 1.323 -0.562 0 O-C-N 122.79 -0.241 . . . . 0.0 110.385 -179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.454 ' H ' ' HB3' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -62.72 -45.52 92.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.661 179.269 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.52 ' HA2' HD22 ' A' ' 84' ' ' LEU . . . 115.81 8.87 13.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.164 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -71.82 80.07 0.88 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.263 0.554 . . . . 0.0 110.652 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -69.47 172.33 38.87 Favored Glycine 0 N--CA 1.451 -0.357 0 CA-C-N 115.242 -0.89 . . . . 0.0 113.607 -174.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 153.11 -30.74 0.8 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.99 -0.844 . . . . 0.0 110.99 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -74.73 156.47 36.57 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.31 -0.445 . . . . 0.0 110.026 175.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.28 113.5 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.821 0.343 . . . . 0.0 110.827 -179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.404 ' H ' ' HG3' ' A' ' 77' ' ' MET . 0.3 OUTLIER -77.31 99.25 5.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.568 -176.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -79.96 1.48 2.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.974 -179.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -86.1 -13.29 10.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.984 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 84.27 -53.26 4.82 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.867 -0.683 . . . . 0.0 111.948 -178.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.9 mm-40 -72.33 141.62 83.53 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-O 120.517 0.199 . . . . 0.0 110.488 177.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 88.6 Cg_exo -52.24 -64.79 0.17 Allowed 'Trans proline' 0 C--N 1.346 0.446 0 C-N-CA 123.285 2.657 . . . . 0.0 112.936 -178.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.416 ' HB ' ' H ' ' A' ' 84' ' ' LEU . 0.3 OUTLIER 58.35 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.249 178.056 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.52 HD22 ' HA2' ' A' ' 71' ' ' GLY . 0.1 OUTLIER -80.46 98.78 7.69 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.99 0.424 . . . . 0.0 110.306 179.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -96.39 34.9 1.54 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.098 -178.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 66.2 77.71 0.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.586 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 85.91 -71.02 2.92 Favored Glycine 0 C--O 1.221 -0.675 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.949 179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.93 79.59 9.17 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 117.07 0.435 . . . . 0.0 111.093 179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.8 -84.97 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.749 0.785 . . . . 0.0 109.741 177.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -131.83 41.8 1.46 Allowed Glycine 0 N--CA 1.443 -0.838 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.837 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -109.33 -76.95 0.6 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.109 0.48 . . . . 0.0 110.437 -179.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -65.32 -18.29 65.2 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.841 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -101.02 21.81 13.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.452 178.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.05 162.41 16.49 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.584 -179.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.448 ' HB3' ' HE1' ' A' ' 49' ' ' TYR . 3.8 ttm105 -80.75 93.06 6.13 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.456 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 1.3 mt -79.02 156.34 28.45 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.072 -177.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.616 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.99 156.64 3.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.21 176.509 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.41 ' O ' HD23 ' A' ' 19' ' ' LEU . 2.2 t -127.09 142.9 51.41 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.883 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 5.0 mmm180 -86.0 106.16 16.97 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.403 ' HG ' ' H ' ' A' ' 101' ' ' GLU . 1.7 tp -114.03 166.31 11.74 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.438 0.637 . . . . 0.0 111.253 -178.657 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.49 ' HG2' ' CE1' ' A' ' 17' ' ' TYR . 1.1 mt-10 -95.96 139.13 32.6 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.466 176.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 58.3 t30 -81.87 -33.92 30.31 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 169.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.95 -96.85 0.44 Allowed 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.77 -1.105 . . . . 0.0 110.191 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -174.49 96.72 0.09 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.083 -0.962 . . . . 0.0 108.615 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.467 ' HB3' ' H ' ' A' ' 106' ' ' ASP . 1.8 t80 -157.7 -84.6 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -171.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.72 ' HB2' ' CD1' ' A' ' 17' ' ' TYR . 26.6 t0 24.86 -86.7 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.171 1.788 . . . . 0.0 113.475 -175.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.977 ' HB1' ' HB ' ' A' ' 111' ' ' ILE . . . -159.76 35.04 0.19 Allowed 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 114.511 -1.222 . . . . 0.0 110.363 -179.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.601 ' HA ' ' HA ' ' A' ' 113' ' ' ASP . . . -65.45 -8.16 17.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.503 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -64.87 -25.58 67.96 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.195 177.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 152.9 -21.94 0.79 Allowed Glycine 0 N--CA 1.447 -0.604 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.357 179.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.977 ' HB ' ' HB1' ' A' ' 107' ' ' ALA . 19.0 mm -68.07 -37.35 78.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.96 0.409 . . . . 0.0 110.854 -179.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -163.95 69.51 0.19 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.49 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.601 ' HA ' ' HA ' ' A' ' 108' ' ' ALA . 0.5 OUTLIER -82.6 115.8 21.73 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.487 179.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.751 -0.642 . . . . 0.0 110.596 -177.407 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.678 0 N-CA-C 111.798 -0.521 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.4 m -112.67 -125.89 0.28 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 20.4 mt -73.31 174.95 7.36 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.896 0.379 . . . . 0.0 110.307 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.424 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -88.12 155.23 19.89 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.09 0.471 . . . . 0.0 110.481 179.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.406 ' HA ' ' HA ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -134.66 134.71 41.45 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.064 176.585 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -92.69 146.86 23.33 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.904 -177.385 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -91.61 -0.32 72.8 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.62 -0.8 . . . . 0.0 112.369 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -87.18 -45.46 5.33 Favored Glycine 0 N--CA 1.444 -0.77 0 C-N-CA 120.872 -0.68 . . . . 0.0 111.733 179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 31.0 p -114.54 -32.62 5.83 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.757 0.313 . . . . 0.0 110.87 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 1.4 mm-40 69.34 25.24 5.61 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.663 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 5.6 pt20 -94.83 16.92 14.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.245 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.406 ' HA ' ' HA ' ' A' ' 5' ' ' THR . 19.2 t-20 72.08 136.01 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.893 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.519 HG23 ' NE2' ' A' ' 27' ' ' HIS . 0.7 OUTLIER -98.67 97.56 6.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 121.111 0.482 . . . . 0.0 110.422 178.296 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.39 15.96 22.25 Favored Glycine 0 N--CA 1.447 -0.605 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 174.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -71.86 173.36 8.38 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.11 -1.045 . . . . 0.0 110.424 -177.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -39.28 74.92 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.857 0.361 . . . . 0.0 111.197 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.629 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.5 OUTLIER -134.68 150.73 50.66 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 -178.535 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.656 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.0 p90 -150.66 -178.51 6.6 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.132 0.491 . . . . 0.0 112.007 -177.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.982 HD22 ' HB ' ' A' ' 97' ' ' ILE . 13.6 mt -133.74 152.72 51.95 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.91 -176.048 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.5 ' HE2' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -144.64 170.2 16.54 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 170.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -175.56 -81.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.49 -0.484 . . . . 0.0 112.21 178.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.435 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 2.8 mt -39.43 -55.64 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 114.852 -1.067 . . . . 0.0 112.388 -174.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 28.1 t70 176.87 -11.96 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.081 177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -120.6 -170.86 2.06 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.782 -1.099 . . . . 0.0 109.381 179.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.474 ' HD1' ' HG2' ' A' ' 20' ' ' LYS . 9.9 m-85 -106.02 156.48 18.35 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.908 0.385 . . . . 0.0 110.969 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.435 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 65.9 m95 -141.28 -171.25 3.25 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.402 -175.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 3.9 m80 -115.09 167.46 10.79 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 171.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.938 ' HA ' HD12 ' A' ' 19' ' ' LEU . 1.9 mt-10 -68.03 -49.74 59.61 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 121.306 0.574 . . . . 0.0 110.263 176.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -90.12 5.07 48.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.005 -175.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.891 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.0 m -99.46 -48.73 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.321 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.784 ' HG ' HD11 ' A' ' 40' ' ' LEU . 13.5 tp -65.18 94.14 0.14 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.576 0.703 . . . . 0.0 111.099 -176.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -131.59 173.87 10.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.406 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.454 ' HB2' ' H ' ' A' ' 56' ' ' CYS . 28.0 p -76.27 168.94 19.14 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 120.938 -0.305 . . . . 0.0 110.778 -178.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' H ' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -62.98 -58.73 6.34 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -170.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.3 tp -88.78 -61.95 1.59 Allowed 'General case' 0 C--N 1.323 -0.587 0 C-N-CA 120.387 -0.525 . . . . 0.0 112.409 -170.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.09 -49.66 69.16 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.581 -177.691 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 65.72 45.53 88.42 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 115.855 -0.611 . . . . 0.0 113.551 172.771 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.59 -81.96 0.34 Allowed 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 175.715 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.3 mmt85 -152.53 -162.16 1.45 Allowed 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.784 HD11 ' HG ' ' A' ' 31' ' ' LEU . 10.7 mt -119.47 144.54 46.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.829 0.347 . . . . 0.0 110.326 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -95.66 42.96 2.23 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.168 -178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.478 ' HB3' ' C ' ' A' ' 95' ' ' ARG . 0.1 OUTLIER -74.83 126.96 32.05 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.792 -0.204 . . . . 0.0 110.812 -178.399 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -143.71 4.0 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 177.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 154.41 10.05 0.07 OUTLIER Glycine 0 CA--C 1.528 0.887 0 C-N-CA 118.559 -1.782 . . . . 0.0 116.183 172.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.491 ' HB3' ' H ' ' A' ' 46' ' ' ARG . 6.8 ttm180 -109.41 -98.58 0.39 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 119.499 1.649 . . . . 0.0 112.49 -173.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.491 ' H ' ' HB3' ' A' ' 45' ' ' ARG . 2.6 ptm180 -148.19 154.96 40.81 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.943 -173.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.883 HD12 ' HG2' ' A' ' 95' ' ' ARG . 0.9 OUTLIER -69.65 108.54 3.91 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.901 0.381 . . . . 0.0 111.623 -178.422 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.464 ' H ' ' HG3' ' A' ' 95' ' ' ARG . 3.8 m-85 -78.2 115.79 18.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.951 177.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -161.39 165.54 28.75 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.601 0.238 . . . . 0.0 110.596 179.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.0 mttt -99.09 165.13 11.87 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.523 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.5 pt? -31.21 -48.62 0.13 Allowed 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 113.961 1.097 . . . . 0.0 113.961 -175.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.523 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -141.58 26.59 2.4 Favored Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.573 -0.822 . . . . 0.0 111.966 178.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -136.44 130.32 32.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.651 0.262 . . . . 0.0 110.781 -178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.437 ' HG3' ' H ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -89.95 99.13 12.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.91 176.677 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 1.4 pt? -139.98 173.21 11.75 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -177.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.566 ' HA ' ' NH2' ' A' ' 95' ' ' ARG . 27.6 p -86.33 -174.17 4.91 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-O 121.132 0.491 . . . . 0.0 109.928 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.651 HH11 ' HE1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -91.18 -13.48 32.81 Favored 'General case' 0 C--N 1.311 -1.107 0 CA-C-N 115.558 -0.747 . . . . 0.0 109.678 174.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.777 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.5 mpt_? -82.0 -51.72 7.76 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.991 -176.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.548 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 3.5 p30 -81.91 -10.48 59.27 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.859 -0.336 . . . . 0.0 110.372 178.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.651 ' HE1' HH11 ' A' ' 57' ' ' ARG . 0.0 OUTLIER -72.61 -33.56 66.76 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 168.641 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.09 -69.61 0.52 Allowed 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.037 176.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 -79.39 0.09 Allowed 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.103 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.33 -35.36 2.79 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 169.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.777 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -140.52 -60.78 0.04 OUTLIER Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.86 176.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' ' H ' ' A' ' 88' ' ' GLU . . . -144.81 41.43 1.08 Allowed Glycine 0 C--O 1.226 -0.369 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.764 -178.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 m 28.96 42.82 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 113.898 1.074 . . . . 0.0 113.898 -173.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -117.48 -70.86 0.41 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.891 -0.671 . . . . 0.0 111.86 178.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 99.79 -4.9 57.97 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.336 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -96.32 159.91 14.7 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -67.04 -51.64 52.26 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 178.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -86.6 102.89 2.77 Favored Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.848 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.482 ' CB ' ' HB2' ' A' ' 88' ' ' GLU . 0.6 OUTLIER -89.6 -163.8 1.06 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.634 0.254 . . . . 0.0 110.863 -177.742 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.686 ' HA3' HD13 ' A' ' 84' ' ' LEU . . . -83.55 -87.51 0.81 Allowed Glycine 0 N--CA 1.447 -0.574 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.667 -178.354 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.17 -143.58 25.2 Favored Glycine 0 N--CA 1.447 -0.624 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.372 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.6 p-10 -101.4 95.96 6.84 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-O 121.558 0.694 . . . . 0.0 110.432 -179.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.46 175.11 10.73 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.887 -178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 9.5 mtt -56.23 135.55 53.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.942 0.401 . . . . 0.0 111.523 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.683 HG21 ' HA ' ' A' ' 82' ' ' PRO . 14.8 p -155.68 145.82 12.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.172 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 69.1 t -60.73 -42.65 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.952 0.406 . . . . 0.0 111.175 -177.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -156.53 -99.24 0.16 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.908 177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.0 OUTLIER -66.14 123.96 86.59 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.186 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.683 ' HA ' HG21 ' A' ' 78' ' ' VAL . 11.7 Cg_exo -69.33 144.95 58.1 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 122.212 1.941 . . . . 0.0 111.962 -177.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -167.92 119.05 0.83 Allowed 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.165 -178.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.686 HD13 ' HA3' ' A' ' 73' ' ' GLY . 1.3 mt -120.37 149.37 42.45 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.429 -175.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -113.16 1.19 15.17 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.984 0.421 . . . . 0.0 110.635 -178.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -87.52 -99.48 0.88 Allowed Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.914 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -135.31 -177.28 14.85 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-O 119.116 -0.824 . . . . 0.0 111.798 178.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' H ' ' HA3' ' A' ' 65' ' ' GLY . 1.8 mp0 12.24 78.49 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 125.22 1.408 . . . . 0.0 113.702 176.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.485 ' HD1' ' HB2' ' A' ' 84' ' ' LEU . 2.2 m-85 -72.71 -82.78 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 114.55 -1.205 . . . . 0.0 111.533 -173.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.432 ' H ' ' HB2' ' A' ' 89' ' ' PHE . . . -153.87 98.41 0.18 Allowed Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 -179.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -123.26 -82.68 0.65 Allowed 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.958 -0.121 . . . . 0.0 111.039 -175.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 94' ' ' GLU . 2.4 mp0 70.64 109.18 0.06 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.161 -0.927 . . . . 0.0 108.641 -168.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.463 ' CG ' HH12 ' A' ' 95' ' ' ARG . 28.0 t70 -70.08 38.06 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 114.028 -1.442 . . . . 0.0 112.175 -174.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.427 ' H ' ' C ' ' A' ' 92' ' ' GLU . 3.7 mm-40 -61.25 154.26 24.05 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.856 -176.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.883 ' HG2' HD12 ' A' ' 47' ' ' LEU . 2.3 ttm105 -166.85 -167.49 0.97 Allowed 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.692 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -143.78 155.18 44.07 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.982 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -161.34 126.26 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 O-C-N 123.482 0.488 . . . . 0.0 110.281 175.049 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.46 112.16 21.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.266 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.629 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 7.1 mmm180 -77.09 97.84 4.84 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.5 OUTLIER -112.9 168.55 9.6 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.546 0.689 . . . . 0.0 111.419 -176.651 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -110.48 137.54 48.05 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.787 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -71.72 -54.52 10.02 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.016 -0.365 . . . . 0.0 110.016 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.472 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -123.77 -86.42 0.64 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.566 173.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.472 ' H ' ' HB ' ' A' ' 103' ' ' THR . 0.0 OUTLIER -125.94 -63.6 1.1 Allowed 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 174.309 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.431 ' HD1' ' HA ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -157.85 -121.37 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' HB3' ' OD2' ' A' ' 113' ' ' ASP . 17.8 t0 -154.56 -81.06 0.08 Allowed 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.628 ' HB3' ' OD1' ' A' ' 113' ' ' ASP . . . -119.81 -78.21 0.59 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.297 171.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -166.54 -15.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.043 0.757 . . . . 0.0 113.043 177.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . 0.679 ' HB3' ' HA ' ' A' ' 113' ' ' ASP . 30.8 t30 -82.68 -29.94 29.58 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -175.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 107.87 -122.69 6.86 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.212 -0.994 . . . . 0.0 113.014 178.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 10.6 mt -58.5 -58.14 7.91 Favored 'Isoleucine or valine' 0 C--O 1.235 0.339 0 CA-C-O 120.982 0.42 . . . . 0.0 111.235 -176.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -93.21 66.71 4.08 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.45 174.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.679 ' HA ' ' HB3' ' A' ' 109' ' ' ASN . 1.3 t0 -78.31 165.76 23.48 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.879 -176.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.362 -0.828 . . . . 0.0 110.209 -178.349 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.621 0 N-CA-C 111.968 -0.453 . . . . 0.0 111.968 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -91.95 128.78 37.92 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.702 0.286 . . . . 0.0 110.75 -178.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 15.3 mt -79.06 174.16 11.84 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.013 0.435 . . . . 0.0 110.263 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.74 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.3 OUTLIER -81.48 168.51 18.2 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.111 -177.447 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -134.63 130.86 37.06 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.141 175.576 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.552 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.72 141.46 28.88 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.518 -175.429 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.09 -2.15 86.62 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.477 -177.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -89.35 -47.73 3.97 Favored Glycine 0 N--CA 1.446 -0.685 0 C-N-CA 121.008 -0.615 . . . . 0.0 112.534 -179.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.472 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 16.8 p -121.66 -25.93 5.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.73 0.265 . . . . 0.0 111.515 -178.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 36.0 mm-40 63.03 23.04 13.79 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.084 -0.507 . . . . 0.0 112.134 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.472 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -81.0 7.61 10.34 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 111.353 0.131 . . . . 0.0 111.353 -179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 75.33 130.57 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.29 0.636 . . . . 0.0 110.444 -177.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.74 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.6 mt -92.97 105.15 16.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.904 -177.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.72 -0.82 39.76 Favored Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.822 -0.704 . . . . 0.0 111.938 178.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -70.34 163.72 26.0 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 120.853 0.358 . . . . 0.0 110.334 179.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.477 ' HB3' ' CD1' ' A' ' 105' ' ' PHE . 21.9 ptt180 -79.17 -29.76 43.14 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.278 -179.123 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.485 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -127.31 145.97 50.6 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -179.289 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.504 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 1.1 p90 -157.86 -172.02 3.77 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.913 0.387 . . . . 0.0 111.342 -176.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.967 HD11 ' HA2' ' A' ' 41' ' ' GLY . 3.5 mt -124.14 135.06 53.24 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.793 179.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.9 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.62 144.32 10.41 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.426 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.75 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 169.52 -36.98 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.775 0 O-C-N 123.667 0.604 . . . . 0.0 110.714 177.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.84 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 5.3 mt -47.46 -51.17 7.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.136 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 27.4 t70 174.61 -17.99 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.09 179.69 6.36 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.229 -1.351 . . . . 0.0 108.583 177.017 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.9 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.7 m-85 -88.48 156.17 19.25 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 177.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.84 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 80.4 m95 -134.12 -165.16 1.6 Allowed 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.119 -177.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.1 m170 -122.68 160.35 26.02 Favored 'General case' 0 C--N 1.31 -1.131 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.676 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' HD12 ' A' ' 19' ' ' LEU . 3.5 mt-10 -66.69 -32.05 73.12 Favored 'General case' 0 C--N 1.322 -0.601 0 O-C-N 123.498 0.499 . . . . 0.0 110.87 178.746 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -115.35 5.25 14.57 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.848 -174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -94.63 -48.53 6.04 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.001 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 31' ' ' LEU . 1.8 mt -62.52 113.36 2.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.28 0.562 . . . . 0.0 111.113 -179.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.54 ' HA ' ' HA ' ' A' ' 39' ' ' ARG . 1.3 m -136.03 174.64 10.4 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.071 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.673 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -57.86 107.19 0.43 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 174.799 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 54' ' ' LYS . 7.6 t70 -64.33 -43.33 94.96 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.195 0.521 . . . . 0.0 110.453 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.746 HD21 HD21 ' A' ' 63' ' ' LEU . 5.8 tp -74.66 -60.47 2.26 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.104 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.9 m -72.44 -54.74 8.46 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.626 -0.715 . . . . 0.0 112.294 -174.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.673 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 111.28 21.46 6.58 Favored Glycine 0 C--N 1.318 -0.429 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.241 177.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.64 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -83.92 -101.99 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 117.271 0.535 . . . . 0.0 110.507 179.49 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.54 ' HA ' ' HA ' ' A' ' 32' ' ' SER . 0.0 OUTLIER -178.47 155.54 0.87 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 117.907 0.321 . . . . 0.0 111.037 179.708 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.466 HD13 HD22 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.91 164.87 27.31 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 173.837 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.967 ' HA2' HD11 ' A' ' 19' ' ' LEU . . . 168.8 48.48 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.118 -1.039 . . . . 0.0 112.754 -178.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.49 ' OE2' ' HD3' ' A' ' 46' ' ' ARG . 1.3 pm0 -139.85 -179.92 6.22 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.834 0.349 . . . . 0.0 110.831 -178.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.711 ' HB ' ' H ' ' A' ' 99' ' ' ARG . 0.1 OUTLIER -124.55 121.23 61.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 176.164 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 163.19 -167.9 37.7 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.296 -0.954 . . . . 0.0 112.116 -174.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.631 ' HA ' HD22 ' A' ' 96' ' ' LEU . 0.0 OUTLIER -80.89 44.71 0.76 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.461 0.648 . . . . 0.0 110.784 177.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.49 ' HD3' ' OE2' ' A' ' 42' ' ' GLU . 0.4 OUTLIER -93.38 -168.18 1.86 Allowed 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.941 178.397 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.466 HD22 HD13 ' A' ' 40' ' ' LEU . 1.0 OUTLIER -22.26 118.78 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -176.089 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.53 ' CB ' ' HA ' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -109.54 131.25 55.24 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 169.667 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 1.056 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.2 OUTLIER -82.82 143.76 30.59 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.314 -0.555 . . . . 0.0 110.579 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 7.9 mtpp -90.59 157.18 17.63 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 178.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.5 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -21.1 -59.85 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 124.904 1.282 . . . . 0.0 114.212 -173.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -125.4 18.46 6.86 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.431 -0.89 . . . . 0.0 112.874 -176.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.467 ' HB2' HD22 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -140.85 115.27 9.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 178.107 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 1.056 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -79.93 57.62 2.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.212 0.529 . . . . 0.0 110.576 177.91 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -110.05 169.95 8.39 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.514 -0.767 . . . . 0.0 111.065 -177.482 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.61 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -66.86 167.16 11.99 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.297 179.77 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.648 ' HG2' HG23 ' A' ' 83' ' ' THR . 1.1 tpp180 -106.08 -43.22 4.89 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.101 0.477 . . . . 0.0 110.393 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.437 HH11 ' HD2' ' A' ' 58' ' ' ARG . 8.9 mmt180 -69.66 -35.11 74.87 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.015 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.61 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 48.9 m-20 -81.4 -25.81 35.93 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.919 176.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.496 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -63.22 -37.02 85.61 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 172.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.443 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -66.03 -9.75 33.52 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.953 -0.567 . . . . 0.0 112.2 -176.751 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.71 -20.52 58.3 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.363 -0.535 . . . . 0.0 110.802 175.741 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.746 HD21 HD21 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -116.83 -42.66 2.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.799 176.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -86.17 23.13 10.06 Favored Glycine 0 C--N 1.329 0.16 0 N-CA-C 111.604 -0.598 . . . . 0.0 111.604 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.443 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -100.22 45.26 1.5 Allowed Glycine 0 N--CA 1.445 -0.715 0 CA-C-N 115.008 -0.596 . . . . 0.0 111.696 -179.291 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -45.43 -21.47 0.1 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 113.62 0.97 . . . . 0.0 113.62 -173.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.467 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -70.89 -10.77 68.61 Favored Glycine 0 CA--C 1.523 0.537 0 C-N-CA 121.016 -0.611 . . . . 0.0 112.678 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 78.76 -120.11 5.25 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 121.604 -0.331 . . . . 0.0 112.645 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.09 -39.0 13.16 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 178.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 2.2 mtt -62.14 -57.27 12.15 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.45 178.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.467 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 60.51 45.89 95.41 Favored Glycine 0 N--CA 1.449 -0.439 0 CA-C-N 115.794 -0.639 . . . . 0.0 112.21 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.434 ' HA ' ' HA3' ' A' ' 87' ' ' GLY . 0.3 OUTLIER -107.45 54.78 0.66 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.047 0.451 . . . . 0.0 110.227 -178.774 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.635 ' H ' ' HE1' ' A' ' 89' ' ' PHE . . . -75.55 -50.58 7.99 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.957 -175.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.87 -70.57 2.71 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.825 -0.702 . . . . 0.0 111.651 -176.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 18.4 t0 -135.59 106.54 6.65 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 175.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -112.31 113.96 45.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.283 -177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.8 mtp -71.36 98.06 1.71 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.612 -176.253 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.406 ' HB ' ' H ' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -168.22 -162.28 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.445 177.059 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.406 ' H ' ' HB ' ' A' ' 78' ' ' VAL . 3.1 t -109.61 38.98 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 172.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -88.81 -72.08 1.27 Allowed Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 115.222 -0.899 . . . . 0.0 112.419 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.462 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 1.9 mt-10 62.28 79.58 0.27 Allowed Pre-proline 0 CA--C 1.534 0.331 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 -179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.422 ' HA ' ' HE1' ' A' ' 60' ' ' TYR . 4.4 Cg_endo -92.62 162.09 2.87 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.231 2.621 . . . . 0.0 113.388 -175.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.648 HG23 ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -77.51 165.76 23.94 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 1.8 mp -66.65 99.0 0.56 Allowed 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.03 -47.94 3.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.839 0.352 . . . . 0.0 110.712 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -135.96 -78.23 0.09 OUTLIER Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.024 179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.434 ' HA3' ' HA ' ' A' ' 72' ' ' SER . . . -81.53 48.07 3.76 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 121.284 -0.484 . . . . 0.0 112.369 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 20.71 81.63 0.01 OUTLIER 'General case' 0 C--O 1.234 0.25 0 C-N-CA 125.285 1.434 . . . . 0.0 114.614 174.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.635 ' HE1' ' H ' ' A' ' 73' ' ' GLY . 0.1 OUTLIER -86.72 -151.62 0.17 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.2 -0.454 . . . . 0.0 109.84 175.539 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -179.96 108.16 0.23 Allowed Glycine 0 N--CA 1.444 -0.832 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.521 ' O ' ' HB2' ' A' ' 92' ' ' GLU . 23.0 p-10 -70.89 -59.25 2.9 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.861 0.362 . . . . 0.0 110.415 -177.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.521 ' HB2' ' O ' ' A' ' 91' ' ' ASP . 4.7 mt-10 77.32 -5.53 2.14 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.796 -176.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.461 ' OD2' ' HG ' ' A' ' 51' ' ' LEU . 1.0 OUTLIER -84.4 22.38 1.27 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.356 -1.293 . . . . 0.0 108.844 171.415 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.53 ' HA ' ' CB ' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -78.84 61.95 3.2 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.093 -0.958 . . . . 0.0 112.045 -171.457 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.596 ' HB3' ' HD1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -89.17 86.12 6.8 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.013 0.435 . . . . 0.0 109.872 173.546 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 45' ' ' ARG . 3.1 pp -78.52 174.2 11.59 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.353 -178.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.75 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.1 OUTLIER -108.84 156.75 9.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.175 0.512 . . . . 0.0 111.151 179.806 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.9 t -130.33 152.77 49.38 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.936 178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.711 ' H ' ' HB ' ' A' ' 43' ' ' VAL . 6.1 mmm-85 -85.92 125.8 33.61 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 178.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.479 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -127.21 176.0 7.72 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.429 0.633 . . . . 0.0 111.797 -173.191 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 101' ' ' GLU . 0.0 OUTLIER -109.66 144.9 37.38 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.673 175.331 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' H ' ' A' ' 103' ' ' THR . 24.1 t-20 -57.14 -83.53 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.689 0.618 . . . . 0.0 110.836 -179.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.436 HG22 ' HG3' ' A' ' 104' ' ' GLN . 1.8 m -144.66 -123.83 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.196 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.436 ' HG3' HG22 ' A' ' 103' ' ' THR . 0.0 OUTLIER -94.23 40.91 1.08 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.184 0.516 . . . . 0.0 110.129 176.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.477 ' CD1' ' HB3' ' A' ' 16' ' ' ARG . 7.5 t80 -78.81 -70.22 0.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.209 -177.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 107' ' ' ALA . 23.8 t0 -53.64 -77.81 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.288 0.566 . . . . 0.0 110.492 -175.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.406 ' H ' ' HB3' ' A' ' 106' ' ' ASP . . . -167.89 36.78 0.03 OUTLIER 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.424 174.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.447 ' HA ' ' O ' ' A' ' 112' ' ' ASP . . . -100.59 124.35 46.04 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.924 -1.034 . . . . 0.0 110.842 -176.209 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -124.84 22.87 8.04 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.161 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 136.96 -49.53 0.86 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.058 -179.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -108.7 50.78 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.447 ' O ' ' HA ' ' A' ' 108' ' ' ALA . 1.5 t70 61.49 -160.01 0.31 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.845 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -73.28 95.58 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 C--O 1.245 0.838 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.321 -173.414 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.767 0 N-CA-C 112.178 -0.369 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.77 154.08 39.73 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.743 0.306 . . . . 0.0 110.723 179.43 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.83 170.41 16.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.431 -177.421 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.571 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -135.05 137.7 43.18 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.607 0.717 . . . . 0.0 111.575 -177.637 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -131.74 152.43 50.93 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.786 -1.097 . . . . 0.0 111.124 -173.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.458 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -91.73 140.47 29.67 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 178.015 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.9 -13.01 71.9 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.792 -176.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -95.95 -38.71 4.54 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.265 179.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 10' ' ' GLN . 60.3 m -99.05 -62.47 1.23 Allowed 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.774 0.321 . . . . 0.0 111.47 -178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.499 ' HB2' ' O ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER 76.91 25.68 0.82 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.135 -176.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.524 ' NE2' ' HE1' ' A' ' 27' ' ' HIS . 2.1 pm0 -86.13 -8.27 57.98 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.676 177.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.4 t30 87.69 123.73 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 O-C-N 124.457 1.098 . . . . 0.0 109.657 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.536 HD12 ' HG ' ' A' ' 4' ' ' LEU . 5.7 mt -79.95 118.73 28.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.732 -175.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -125.73 5.82 7.96 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.54 -175.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 102' ' ' ASN . 20.9 m-20 -73.08 -175.01 1.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.133 0.492 . . . . 0.0 111.005 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.688 ' HA ' HG22 ' A' ' 103' ' ' THR . 0.4 OUTLIER -86.54 -28.02 23.61 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.35 -179.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -139.74 150.36 44.7 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -175.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.611 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.7 p90 -159.24 -176.49 5.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.766 0.317 . . . . 0.0 111.063 -178.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.829 HD22 ' HB ' ' A' ' 97' ' ' ILE . 16.6 mt -132.79 146.85 52.18 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.552 179.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.852 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -160.88 149.07 16.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.273 -1.01 . . . . 0.0 108.273 177.323 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -179.35 -43.05 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 118.405 0.548 . . . . 0.0 112.451 179.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 8.7 mt -53.63 -55.83 11.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.253 -0.431 . . . . 0.0 112.016 -173.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' GLN . 28.8 t70 174.21 -5.55 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.791 0.805 . . . . 0.0 108.914 -177.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -144.44 168.8 19.26 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.692 177.086 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.852 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 9.2 m-85 -86.73 157.31 19.66 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 120.848 0.356 . . . . 0.0 110.815 -178.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.406 ' CG ' ' HG ' ' A' ' 31' ' ' LEU . 71.3 m95 -137.56 -165.6 1.8 Allowed 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.31 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 6.6 m80 -112.11 166.59 11.11 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 170.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.562 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -62.92 -49.88 73.03 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.02 0.438 . . . . 0.0 110.909 179.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -91.23 4.26 52.74 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 121.118 0.485 . . . . 0.0 111.605 -178.086 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.802 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -91.68 -41.97 10.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.174 -178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.533 HD22 HD11 ' A' ' 40' ' ' LEU . 0.6 OUTLIER -74.54 80.23 1.96 Allowed 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.351 0.596 . . . . 0.0 110.375 177.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -111.0 165.41 11.9 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.747 -178.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.778 ' HB2' ' H ' ' A' ' 37' ' ' GLY . 1.2 m -74.51 164.52 26.49 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.436 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -75.55 -48.91 20.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.902 175.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.64 ' HB3' ' HB2' ' A' ' 59' ' ' ASP . 18.6 tp -94.4 -61.25 1.55 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.345 -178.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.753 ' SG ' ' HB3' ' A' ' 59' ' ' ASP . 8.3 m -55.24 -62.67 1.51 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.237 0.542 . . . . 0.0 111.252 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.778 ' H ' ' HB2' ' A' ' 33' ' ' CYS . . . 86.13 -11.56 62.54 Favored Glycine 0 C--N 1.321 -0.288 0 CA-C-N 115.547 -0.752 . . . . 0.0 112.972 178.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 -81.98 0.14 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 122.783 -0.245 . . . . 0.0 110.83 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.485 ' HD2' ' OE2' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -133.52 177.15 7.92 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 177.158 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.647 HD13 ' HG2' ' A' ' 95' ' ' ARG . 13.3 mt -93.05 -37.68 12.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.935 0.397 . . . . 0.0 111.155 -175.703 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 140.51 -42.3 1.21 Allowed Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 110.98 -0.848 . . . . 0.0 110.98 -177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.536 ' HG3' HG13 ' A' ' 97' ' ' ILE . 1.3 mp0 57.22 27.91 14.32 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 122.992 0.517 . . . . 0.0 112.321 173.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.6 p -139.33 99.16 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-O 121.436 0.636 . . . . 0.0 110.535 178.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 158.96 172.9 26.66 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.829 -0.7 . . . . 0.0 111.865 -177.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.85 3.34 18.86 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.989 0.424 . . . . 0.0 110.918 -179.186 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.489 ' CD ' ' HG3' ' A' ' 92' ' ' GLU . 4.3 mtp85 -129.68 170.51 13.72 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.281 178.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.717 ' HG ' ' HG3' ' A' ' 95' ' ' ARG . 6.0 tt -140.69 121.61 14.53 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -126.17 144.78 50.63 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.068 -175.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.702 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 46.4 p90 -146.53 157.21 43.7 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 176.342 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.696 ' HB2' HD22 ' A' ' 55' ' ' LEU . 1.6 tptt -83.99 171.74 12.69 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.656 0.265 . . . . 0.0 111.155 -175.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.681 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -66.82 52.79 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 124.243 1.017 . . . . 0.0 112.896 -174.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 135.7 -0.85 3.47 Favored Glycine 0 C--N 1.308 -0.976 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.825 178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -131.64 119.08 20.91 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 110.187 -0.301 . . . . 0.0 110.187 179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.702 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -82.2 66.37 7.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.304 0.573 . . . . 0.0 109.7 176.757 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.696 HD22 ' HB2' ' A' ' 50' ' ' LYS . 1.1 pt? -98.66 169.95 9.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.889 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.419 ' O ' ' HG ' ' A' ' 55' ' ' LEU . 31.8 p -99.34 -173.83 2.58 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.327 0.584 . . . . 0.0 110.125 176.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.872 ' HB3' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -78.11 -32.77 50.71 Favored 'General case' 0 C--N 1.311 -1.085 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.215 177.448 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.519 ' HD3' ' OE1' ' A' ' 94' ' ' GLU . 0.4 OUTLIER -74.43 -44.84 50.05 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.074 -176.181 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.753 ' HB3' ' SG ' ' A' ' 36' ' ' CYS . 0.9 OUTLIER -80.18 -8.9 59.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.809 0.338 . . . . 0.0 110.677 178.793 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER -79.31 -39.79 31.98 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 171.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.582 HD12 ' HA2' ' A' ' 65' ' ' GLY . 0.1 OUTLIER -69.77 -57.89 4.56 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.919 177.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.415 ' HB3' ' H ' ' A' ' 63' ' ' LEU . 5.4 tpp180 -162.93 -99.29 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.038 175.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.731 ' H ' HD13 ' A' ' 63' ' ' LEU . 0.0 OUTLIER -106.34 -50.42 3.15 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 110.065 -0.346 . . . . 0.0 110.065 176.068 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.644 ' N ' HD22 ' A' ' 63' ' ' LEU . . . -126.59 7.14 7.46 Favored Glycine 0 N--CA 1.453 -0.215 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.689 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.582 ' HA2' HD12 ' A' ' 61' ' ' LEU . . . 25.91 43.71 0.02 OUTLIER Glycine 0 N--CA 1.468 0.812 0 N-CA-C 116.178 1.231 . . . . 0.0 116.178 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.54 -45.79 51.46 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.017 0.437 . . . . 0.0 110.895 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.433 ' HA3' ' HA2' ' A' ' 71' ' ' GLY . . . -139.36 -19.88 0.44 Allowed Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.518 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 83.63 -69.43 3.36 Favored Glycine 0 N--CA 1.448 -0.506 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.379 -178.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.36 -58.48 0.69 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.013 0.435 . . . . 0.0 110.31 179.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 44.7 mtm -76.45 -70.58 0.44 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.711 -179.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.433 ' HA2' ' HA3' ' A' ' 67' ' ' GLY . . . 156.27 -60.15 0.36 Allowed Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.981 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -118.77 65.27 0.77 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.031 0.443 . . . . 0.0 110.054 178.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.414 ' HA3' ' HE1' ' A' ' 89' ' ' PHE . . . -58.74 109.5 2.06 Favored Glycine 0 N--CA 1.449 -0.473 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.571 -178.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -164.03 -111.83 0.26 Allowed Glycine 0 N--CA 1.442 -0.932 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -83.66 93.58 7.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.049 0.452 . . . . 0.0 109.925 173.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.446 ' HB ' HG13 ' A' ' 79' ' ' VAL . 1.9 t -137.49 162.88 32.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.85 -177.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.3 mtm -54.95 109.54 0.53 Allowed 'General case' 0 C--O 1.234 0.242 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 5.2 t 50.55 76.26 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 O-C-N 123.839 0.712 . . . . 0.0 111.808 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.446 HG13 ' HB ' ' A' ' 76' ' ' VAL . 0.0 OUTLIER -101.63 -20.82 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.735 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.488 178.363 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 82.45 2.03 90.55 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -173.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.773 ' HA ' HD21 ' A' ' 84' ' ' LEU . 5.5 mp0 46.15 69.77 2.43 Favored Pre-proline 0 C--O 1.232 0.168 0 C-N-CA 123.759 0.824 . . . . 0.0 111.763 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.444 ' HB2' ' H ' ' A' ' 83' ' ' THR . 59.6 Cg_endo -88.46 -128.39 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.619 0 C-N-CA 123.243 2.628 . . . . 0.0 111.206 179.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.505 ' HB ' ' HB3' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -78.12 77.65 4.62 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-O 120.871 0.367 . . . . 0.0 110.501 176.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.773 HD21 ' HA ' ' A' ' 81' ' ' GLU . 0.2 OUTLIER -74.23 98.64 3.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.992 0.425 . . . . 0.0 110.53 -175.941 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -136.94 24.41 3.05 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.356 -175.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 65.79 55.94 17.26 Favored Glycine 0 N--CA 1.453 -0.185 0 C-N-CA 120.804 -0.712 . . . . 0.0 113.095 176.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 86.03 -58.3 4.77 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.365 176.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.478 ' CD ' HH22 ' A' ' 58' ' ' ARG . 1.1 mt-10 -87.16 67.67 9.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.613 0.244 . . . . 0.0 110.945 -177.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.505 ' HB3' ' HB ' ' A' ' 83' ' ' THR . 0.0 OUTLIER -75.99 139.49 41.54 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 110.938 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.72 ' HA3' ' HD2' ' A' ' 57' ' ' ARG . . . 174.97 -101.25 0.16 Allowed Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.421 -0.809 . . . . 0.0 112.433 176.419 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.611 ' CG ' ' H ' ' A' ' 92' ' ' GLU . 11.1 p-10 -105.83 -102.92 0.33 Allowed 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 114.914 -0.643 . . . . 0.0 110.677 -178.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.611 ' H ' ' CG ' ' A' ' 91' ' ' ASP . 0.5 OUTLIER -142.65 -52.66 0.39 Allowed 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 122.347 -0.221 . . . . 0.0 111.098 178.437 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.465 ' C ' ' HG2' ' A' ' 94' ' ' GLU . 0.2 OUTLIER -140.81 26.16 2.1 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.624 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.872 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 0.0 OUTLIER 41.33 -108.34 0.09 Allowed 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 124.803 1.241 . . . . 0.0 114.086 179.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.717 ' HG3' ' HG ' ' A' ' 47' ' ' LEU . 0.5 OUTLIER -132.29 125.61 31.42 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -167.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.518 ' O ' HD12 ' A' ' 47' ' ' LEU . 0.1 OUTLIER -122.12 159.89 26.2 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 171.225 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.829 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -153.67 141.76 13.49 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.667 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 173.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -104.61 122.21 45.14 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 178.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.812 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -90.17 99.05 12.14 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 -178.307 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.611 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.3 OUTLIER -90.76 164.23 14.18 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.519 0.676 . . . . 0.0 111.59 -173.741 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.64 109.51 22.12 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 114.38 -1.282 . . . . 0.0 109.448 175.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 15' ' ' ASP . 65.4 t30 -67.2 -40.89 86.56 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.6 -176.147 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.688 HG22 ' HA ' ' A' ' 16' ' ' ARG . 3.0 t -102.17 -123.59 0.18 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 175.283 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.9 70.67 1.29 Allowed 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -162.63 101.56 1.04 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.252 -175.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -96.37 -81.99 0.4 Allowed 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.082 0.467 . . . . 0.0 110.139 177.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.432 ' H ' ' HA ' ' A' ' 113' ' ' ASP . . . 64.07 37.0 9.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.798 -1.092 . . . . 0.0 111.189 -179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -95.38 -171.74 2.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.056 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -91.2 22.03 4.03 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.8 0.333 . . . . 0.0 111.139 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -79.49 -87.13 0.54 Allowed Glycine 0 N--CA 1.447 -0.572 0 C-N-CA 120.728 -0.748 . . . . 0.0 111.34 176.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -103.59 -69.53 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -166.01 -108.96 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.136 172.306 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.432 ' HA ' ' H ' ' A' ' 107' ' ' ALA . 15.5 t0 -120.31 97.15 5.45 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 172.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 . . . . . 0 C--O 1.246 0.888 0 CA-C-O 118.831 -0.604 . . . . 0.0 110.236 -177.721 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.831 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.88 122.01 19.14 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.916 0.388 . . . . 0.0 110.611 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.24 166.58 22.01 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.216 0.532 . . . . 0.0 111.168 -177.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.56 ' HB2' HD12 ' A' ' 13' ' ' ILE . 1.5 mp -120.9 164.92 15.94 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.952 179.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -126.0 132.05 52.1 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.703 0.287 . . . . 0.0 110.704 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -85.35 148.67 25.91 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.837 -179.799 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -92.27 2.34 74.59 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.371 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -92.33 -49.91 2.7 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.0 -179.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.63 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 17.4 p -113.93 -24.95 8.81 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.701 0.286 . . . . 0.0 110.588 178.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.444 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 62.34 26.29 15.71 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.575 -0.739 . . . . 0.0 112.132 177.028 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.63 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.3 OUTLIER -91.87 11.69 24.04 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.689 -0.232 . . . . 0.0 111.368 -179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.436 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 13.8 t30 76.26 134.06 0.05 Allowed 'General case' 0 N--CA 1.469 0.521 0 O-C-N 123.762 0.664 . . . . 0.0 111.081 -179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.56 HD12 ' HB2' ' A' ' 4' ' ' LEU . 5.7 mt -88.17 107.47 17.56 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.813 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -111.81 17.33 25.28 Favored Glycine 0 N--CA 1.446 -0.645 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.609 179.629 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.0 m-20 -77.76 174.69 10.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.799 0.333 . . . . 0.0 110.174 178.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.655 ' HB2' ' O ' ' A' ' 110' ' ' GLY . 6.1 ptt180 -90.13 -30.7 17.48 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.13 175.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.538 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.4 OUTLIER -133.53 141.41 47.72 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 177.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.595 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 6.1 p90 -148.82 -177.83 6.01 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.997 0.427 . . . . 0.0 111.454 -176.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.877 HD21 ' HD2' ' A' ' 99' ' ' ARG . 25.5 mt -125.28 145.2 50.12 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.539 -178.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 1.005 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.02 142.4 11.82 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.855 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.445 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . -168.33 -58.2 0.02 OUTLIER 'General case' 0 CA--C 1.522 -0.132 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -171.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.976 HG12 HD13 ' A' ' 47' ' ' LEU . 1.8 mt -44.46 -51.41 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.872 -172.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.1 t0 177.41 -9.84 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.38 178.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -136.99 -167.87 2.17 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.886 -1.052 . . . . 0.0 109.464 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 1.005 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 1.5 m-85 -100.47 153.82 19.04 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.71 0.29 . . . . 0.0 110.784 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.497 ' CZ2' HD12 ' A' ' 22' ' ' ILE . 74.6 m95 -140.32 -173.13 3.59 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.362 -177.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.6 m80 -110.8 167.05 10.53 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.522 176.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.12 -47.85 83.76 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 123.354 0.409 . . . . 0.0 111.23 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.28 -4.49 24.2 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.953 0.406 . . . . 0.0 111.802 -176.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.991 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.8 m -78.68 -42.84 27.44 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.018 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.8 tp -75.03 56.45 0.76 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.544 0.688 . . . . 0.0 110.616 177.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.949 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 2.1 m -129.04 -161.48 1.12 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.871 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.919 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 1.1 m -47.67 121.34 3.96 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 123.753 0.658 . . . . 0.0 110.933 177.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 4.1 t70 -85.87 -55.18 4.08 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.033 0.444 . . . . 0.0 110.246 -179.558 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.431 ' HB2' HD12 ' A' ' 55' ' ' LEU . 1.3 tp -62.33 -60.15 3.97 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.541 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.402 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.8 OUTLIER -73.62 -56.59 4.81 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.855 -177.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.919 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 101.63 25.05 8.33 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.672 -0.775 . . . . 0.0 113.427 177.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.466 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -92.06 -104.95 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 117.155 0.477 . . . . 0.0 110.75 178.28 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.949 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 1.0 OUTLIER -166.5 159.49 14.48 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 118.109 0.413 . . . . 0.0 111.471 -178.717 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.811 HD13 ' HG3' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -136.37 137.65 40.78 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 176.567 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 168.36 62.9 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.537 0 C-N-CA 119.581 -1.295 . . . . 0.0 114.526 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.588 ' HB2' ' O ' ' A' ' 81' ' ' GLU . 5.3 mt-10 -118.84 -82.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.14 0.47 . . . . 0.0 110.367 172.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.632 ' HB ' ' HB2' ' A' ' 77' ' ' MET . 0.0 OUTLIER -137.96 132.66 43.73 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.651 0 CA-C-O 120.446 0.165 . . . . 0.0 110.697 177.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.559 ' CA ' ' HB3' ' A' ' 77' ' ' MET . . . -156.93 -169.93 21.37 Favored Glycine 0 N--CA 1.461 0.329 0 N-CA-C 111.351 -0.7 . . . . 0.0 111.351 -179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.702 ' HD3' ' OD1' ' A' ' 93' ' ' ASP . 0.0 OUTLIER -137.56 -69.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 118.03 0.915 . . . . 0.0 111.19 177.352 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' HB3' ' A' ' 96' ' ' LEU . 2.6 mtm180 -117.27 -173.64 2.45 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.976 HD13 HG12 ' A' ' 22' ' ' ILE . 0.2 OUTLIER -117.17 149.74 39.87 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -174.521 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.638 ' HE2' ' HB2' ' A' ' 91' ' ' ASP . 6.2 m-85 -116.7 146.12 42.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 114.564 -1.198 . . . . 0.0 109.935 175.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 1.021 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 24.5 p90 -155.74 153.1 29.37 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 170.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.543 ' HD2' HD22 ' A' ' 55' ' ' LEU . 11.7 mttt -92.84 169.96 10.06 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 -176.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.507 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -26.47 -62.94 0.08 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.713 1.205 . . . . 0.0 113.829 -174.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.13 16.56 7.66 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 119.933 -1.127 . . . . 0.0 113.525 -175.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.2 ptt180 -152.25 137.05 17.08 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 117.161 0.481 . . . . 0.0 111.327 178.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 1.021 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.1 OUTLIER -78.28 66.12 3.78 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.473 0.654 . . . . 0.0 109.85 174.609 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.593 ' HG ' ' N ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -79.64 155.41 28.09 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.157 -0.928 . . . . 0.0 109.984 -177.261 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.593 ' N ' ' HG ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -64.85 138.94 58.68 Favored 'General case' 0 N--CA 1.44 -0.945 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.413 178.735 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.449 ' HD3' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -87.36 -24.31 24.3 Favored 'General case' 0 C--N 1.308 -1.21 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 173.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.702 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 0.5 OUTLIER -70.53 -45.51 65.38 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.82 -1.082 . . . . 0.0 110.604 179.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.499 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 37.5 m-20 -81.4 -18.01 46.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.918 0.39 . . . . 0.0 110.27 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.449 ' CD1' ' HD3' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -73.55 -30.31 62.98 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.229 173.054 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.23 -61.74 1.66 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.571 0.701 . . . . 0.0 110.729 177.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 59' ' ' ASP . 1.0 OUTLIER -145.09 -99.98 0.1 Allowed 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 178.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.573 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.1 OUTLIER -125.87 -36.07 2.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.241 0.543 . . . . 0.0 109.67 166.576 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -141.6 43.74 1.06 Allowed Glycine 0 C--O 1.225 -0.452 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.224 -176.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -65.05 40.63 0.11 Allowed Glycine 0 CA--C 1.527 0.82 0 N-CA-C 115.235 0.854 . . . . 0.0 115.235 -172.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.602 ' OG ' ' HD2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.1 47.09 0.89 Allowed 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 123.32 0.648 . . . . 0.0 110.642 179.245 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.721 ' HA2' ' O ' ' A' ' 87' ' ' GLY . . . 29.37 -98.48 0.01 OUTLIER Glycine 0 C--N 1.334 0.44 0 O-C-N 124.106 0.879 . . . . 0.0 114.911 -169.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.775 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . -171.44 -122.53 0.65 Allowed Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 119.647 -1.263 . . . . 0.0 112.878 177.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.402 ' HB3' ' H ' ' A' ' 70' ' ' MET . 4.5 t-80 -136.93 -86.98 0.31 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.88 0.372 . . . . 0.0 111.455 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.402 ' H ' ' HB3' ' A' ' 69' ' ' HIS . 0.7 OUTLIER -90.26 -46.86 8.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.804 -176.318 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -106.96 35.84 4.78 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.901 -0.666 . . . . 0.0 112.304 -179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.775 ' HB3' ' HA3' ' A' ' 68' ' ' GLY . 4.7 t -173.23 158.61 3.65 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 66.04 -169.54 31.17 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.91 179.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 92' ' ' GLU . . . -121.95 -53.93 0.22 Allowed Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 121.067 -0.587 . . . . 0.0 112.615 -179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -80.51 158.91 25.69 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.583 0.23 . . . . 0.0 110.955 -179.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.3 t -100.36 93.89 3.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 109.825 176.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.632 ' HB2' ' HB ' ' A' ' 43' ' ' VAL . 40.3 mtm -75.93 160.77 29.55 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.54 -174.852 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.615 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -149.99 -36.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 113.173 0.805 . . . . 0.0 113.173 -176.39 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 12.2 t -69.34 -45.69 78.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -166.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.552 ' H ' ' N ' ' A' ' 44' ' ' GLY . . . 144.54 93.35 0.16 Allowed Glycine 0 CA--C 1.521 0.441 0 C-N-CA 119.301 -1.428 . . . . 0.0 114.832 177.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.613 ' HG2' ' O ' ' A' ' 43' ' ' VAL . 1.8 pt-20 -157.95 163.54 24.27 Favored Pre-proline 0 CA--C 1.534 0.344 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 171.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -60.42 -171.76 0.07 OUTLIER 'Trans proline' 0 N--CA 1.48 0.706 0 C-N-CA 122.664 2.243 . . . . 0.0 112.979 -174.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.505 ' OG1' ' HA2' ' A' ' 68' ' ' GLY . 0.5 OUTLIER -177.06 160.16 1.74 Allowed 'General case' 0 CA--C 1.538 0.496 0 O-C-N 122.174 -0.329 . . . . 0.0 111.339 179.209 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 ' HE2' ' A' ' 89' ' ' PHE . 1.0 OUTLIER -105.01 -179.89 4.08 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 121.014 0.435 . . . . 0.0 110.718 178.041 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 19.6 ttt -91.66 -38.11 12.63 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.982 174.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -152.99 120.71 1.08 Allowed Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 121.032 -0.604 . . . . 0.0 112.335 179.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.721 ' O ' ' HA2' ' A' ' 67' ' ' GLY . . . 149.19 106.75 0.4 Allowed Glycine 0 C--O 1.222 -0.635 0 N-CA-C 111.091 -0.804 . . . . 0.0 111.091 -178.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.75 143.08 27.1 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.131 0.465 . . . . 0.0 111.107 -175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.558 ' HD2' ' H ' ' A' ' 67' ' ' GLY . 90.3 m-85 -132.32 -167.55 1.91 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.32 -178.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.79 15.14 12.64 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.747 -173.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.638 ' HB2' ' HE2' ' A' ' 48' ' ' TYR . 1.1 p30 -116.35 -87.12 0.61 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.947 0.374 . . . . 0.0 111.148 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 74' ' ' GLY . 4.2 mt-10 63.83 10.1 4.94 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.424 0.631 . . . . 0.0 110.644 -177.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.702 ' OD1' ' HD3' ' A' ' 45' ' ' ARG . 14.5 t0 -120.69 35.45 4.88 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.434 -1.257 . . . . 0.0 111.104 -171.023 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.531 ' CD ' ' HG2' ' A' ' 58' ' ' ARG . 17.1 tt0 -79.21 -47.56 15.77 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -171.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.975 ' HA ' ' HG ' ' A' ' 47' ' ' LEU . 0.0 OUTLIER -136.47 125.22 23.92 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 118.805 -1.158 . . . . 0.0 114.074 -168.679 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.559 ' O ' HD12 ' A' ' 47' ' ' LEU . 0.1 OUTLIER -124.41 156.81 36.5 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 114.599 -1.182 . . . . 0.0 109.002 172.857 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.541 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -159.9 145.08 6.05 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.594 0 CA-C-O 121.1 0.476 . . . . 0.0 111.093 177.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -121.61 126.33 48.82 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 172.089 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.877 ' HD2' HD21 ' A' ' 19' ' ' LEU . 7.2 mmm180 -76.68 119.01 19.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -178.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.595 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.9 tp -114.15 165.07 13.03 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.921 0.867 . . . . 0.0 111.517 -178.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -119.06 133.48 55.78 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 113.902 -1.499 . . . . 0.0 109.47 -178.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -61.61 -69.73 0.23 Allowed 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.681 0.277 . . . . 0.0 110.835 -177.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.45 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.0 OUTLIER -140.42 -103.87 0.15 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.868 0.366 . . . . 0.0 111.457 179.482 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.467 ' HB2' ' HA ' ' A' ' 113' ' ' ASP . 0.0 OUTLIER -161.79 94.29 0.94 Allowed 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 -179.827 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.514 ' N ' ' H ' ' A' ' 110' ' ' GLY . 12.4 t80 -35.6 -55.16 0.69 Allowed 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -168.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 113' ' ' ASP . 0.3 OUTLIER -37.26 -48.79 0.9 Allowed 'General case' 0 N--CA 1.47 0.549 0 O-C-N 123.727 0.642 . . . . 0.0 112.149 -175.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -124.74 26.39 7.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.63 178.632 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -169.75 -137.74 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.887 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . 0.434 ' O ' ' HA ' ' A' ' 16' ' ' ARG . 29.6 t-20 -131.63 45.38 2.8 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.177 0.513 . . . . 0.0 111.701 -176.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . 0.655 ' O ' ' HB2' ' A' ' 16' ' ' ARG . . . -103.35 -147.48 18.41 Favored Glycine 0 C--O 1.224 -0.478 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.679 176.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -94.02 -60.01 2.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 117.292 0.546 . . . . 0.0 110.28 176.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -132.69 -176.51 4.13 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.217 -0.901 . . . . 0.0 108.824 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.673 ' HB2' ' HB2' ' A' ' 106' ' ' ASP . 15.0 t70 -87.68 142.27 27.96 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.724 0.297 . . . . 0.0 110.491 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.969 -0.539 . . . . 0.0 109.723 179.926 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.85 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.44 140.87 42.63 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.721 0.295 . . . . 0.0 110.649 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' HD21 ' A' ' 12' ' ' ASN . 1.2 mt -100.17 -169.91 1.8 Allowed 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.113 178.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.741 ' HB2' ' CD2' ' A' ' 25' ' ' TYR . 0.7 OUTLIER -134.63 159.57 40.82 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.047 0.451 . . . . 0.0 111.108 178.539 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 137.58 54.61 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.408 -175.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.473 ' HB2' ' C ' ' A' ' 26' ' ' TRP . 0.0 OUTLIER -86.86 149.2 24.99 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.338 -178.023 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -83.1 -1.76 90.56 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.871 -0.68 . . . . 0.0 112.863 -175.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -94.08 -54.35 1.63 Allowed Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.592 -0.813 . . . . 0.0 112.525 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.645 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 15.4 p -109.95 -30.56 7.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.688 0.28 . . . . 0.0 111.096 -178.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 61.21 26.06 15.98 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.902 -179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.645 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -86.68 19.52 2.88 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 120.705 0.288 . . . . 0.0 111.22 -179.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.44 HD21 ' HB2' ' A' ' 3' ' ' LEU . 23.8 t-20 71.93 122.91 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.13 -179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.438 ' HB ' ' HG ' ' A' ' 4' ' ' LEU . 9.4 mt -85.16 98.37 6.25 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-O 121.292 0.568 . . . . 0.0 110.85 -179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -112.76 20.81 19.71 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.467 -1.053 . . . . 0.0 110.467 176.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -73.92 -174.24 1.79 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.246 -0.977 . . . . 0.0 110.833 -175.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.545 ' H ' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -98.23 -32.74 11.41 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.015 0.436 . . . . 0.0 110.293 176.304 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.402 ' HD2' ' HE ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -132.83 144.63 50.34 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 -179.66 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 7.5 p90 -152.21 -177.09 5.97 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.521 -0.471 . . . . 0.0 111.945 -176.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.856 HD22 ' HB ' ' A' ' 97' ' ' ILE . 9.4 mt -134.51 143.76 47.65 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.27 -177.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.875 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -163.1 148.69 11.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.459 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.443 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 173.27 -44.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 112.127 0.417 . . . . 0.0 112.127 176.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.667 ' HB ' ' OE1' ' A' ' 24' ' ' GLN . 13.5 mt -45.21 -43.91 3.19 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 CA-C-N 115.541 -0.754 . . . . 0.0 112.314 -173.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.5 t70 171.12 -19.11 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 CA-C-O 122.29 1.043 . . . . 0.0 108.309 -179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.667 ' OE1' ' HB ' ' A' ' 22' ' ' ILE . 0.3 OUTLIER -132.39 -166.39 1.73 Allowed 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.889 -1.505 . . . . 0.0 109.781 -176.001 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.875 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.5 m-85 -106.53 157.95 17.28 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.529 -0.305 . . . . 0.0 110.329 177.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.493 ' CH2' ' HG2' ' A' ' 54' ' ' LYS . 86.1 m95 -136.59 -169.77 2.53 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.56 0.695 . . . . 0.0 110.946 -178.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.4 m170 -118.0 172.66 7.25 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 114.271 -1.331 . . . . 0.0 108.717 174.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -65.89 -47.71 73.91 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.53 0.205 . . . . 0.0 111.283 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -115.09 16.33 17.04 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.894 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -89.08 -48.45 7.4 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.113 0.482 . . . . 0.0 109.809 175.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.53 108.41 6.37 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.41 174.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.715 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.1 OUTLIER -148.22 -175.13 4.78 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.034 -178.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 1.2 m -52.38 108.33 0.29 Allowed 'General case' 0 CA--C 1.543 0.683 0 O-C-N 123.665 0.603 . . . . 0.0 110.665 176.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -77.35 -72.03 0.38 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.764 -0.653 . . . . 0.0 112.646 -169.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.819 ' HB3' HD13 ' A' ' 55' ' ' LEU . 0.4 OUTLIER -55.69 -44.87 77.78 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.157 0.979 . . . . 0.0 110.112 -179.73 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.656 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -65.25 -39.92 93.3 Favored 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.358 -179.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 75.44 22.46 75.55 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.72 174.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -98.03 -109.73 0.17 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.526 0.663 . . . . 0.0 110.367 178.567 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.2 168.17 19.2 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.715 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 72.3 mt -90.53 111.7 23.09 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.793 0.33 . . . . 0.0 110.391 179.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -144.9 -43.63 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.808 -0.711 . . . . 0.0 111.862 -179.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -87.69 55.56 3.54 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.016 0.436 . . . . 0.0 110.02 176.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.44 ' HA ' HH22 ' A' ' 58' ' ' ARG . 0.9 OUTLIER -129.74 -175.05 1.3 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.029 -176.831 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -111.47 -167.44 18.46 Favored Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 110.206 -1.158 . . . . 0.0 110.206 173.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' HE ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -71.23 -9.52 58.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 117.372 0.586 . . . . 0.0 110.353 177.198 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.881 ' HB3' HD22 ' A' ' 96' ' ' LEU . 2.0 mtp180 -103.13 -169.67 1.68 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.755 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.558 HD13 HD11 ' A' ' 97' ' ' ILE . 0.4 OUTLIER -160.54 176.4 11.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.012 0.434 . . . . 0.0 110.767 177.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 57' ' ' ARG . 72.9 t80 -142.1 144.59 33.61 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.352 176.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.569 ' HE1' ' H ' ' A' ' 95' ' ' ARG . 12.2 p90 -143.22 155.27 44.48 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.51 ' HB2' HD23 ' A' ' 55' ' ' LEU . 23.0 tttt -77.61 157.63 30.16 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.468 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.0 pt? -33.19 -43.41 0.11 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -174.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -135.16 9.76 4.44 Favored Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.331 -0.938 . . . . 0.0 112.99 179.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 mtt180 -125.83 145.6 50.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.868 0.334 . . . . 0.0 110.669 179.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.529 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.3 OUTLIER -88.36 48.96 1.71 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.035 0.445 . . . . 0.0 111.024 178.422 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.819 HD13 ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -104.34 151.21 23.72 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 175.21 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 19.7 p -72.6 -174.43 1.39 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.741 0.781 . . . . 0.0 111.52 -177.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.612 ' HB2' ' CD2' ' A' ' 48' ' ' TYR . 5.9 tpt180 -102.42 -13.1 17.41 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.642 174.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.457 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -78.27 -57.25 3.88 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.331 -176.166 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.731 ' HA ' ' HD2' ' A' ' 62' ' ' ARG . 48.6 m-20 -75.51 -16.32 60.3 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.686 -178.03 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.75 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.3 OUTLIER -76.7 -36.74 57.03 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 114.932 -1.031 . . . . 0.0 109.577 172.883 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.658 ' HG ' ' HA3' ' A' ' 65' ' ' GLY . 0.2 OUTLIER -78.52 -9.12 59.21 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.287 178.127 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.874 HH21 ' HA ' ' A' ' 69' ' ' HIS . 0.0 OUTLIER -65.55 -29.13 69.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.08 0.467 . . . . 0.0 110.389 178.322 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -124.35 -36.76 2.61 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.543 -179.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -83.91 -7.03 86.2 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.437 -179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.658 ' HA3' ' HG ' ' A' ' 61' ' ' LEU . . . -121.15 -109.04 2.12 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.514 177.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -140.36 -72.05 0.37 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 120.879 0.371 . . . . 0.0 110.48 176.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -120.81 -72.55 0.32 Allowed Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.661 -0.78 . . . . 0.0 112.18 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.52 ' HA2' HD22 ' A' ' 84' ' ' LEU . . . 62.1 35.31 91.29 Favored Glycine 0 C--O 1.226 -0.346 0 C-N-CA 120.998 -0.62 . . . . 0.0 112.01 179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.874 ' HA ' HH21 ' A' ' 62' ' ' ARG . 1.8 m-70 -100.59 -37.88 8.59 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.97 0.415 . . . . 0.0 110.553 -177.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -72.42 -25.58 61.53 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.712 -178.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.425 ' HA3' ' HB2' ' A' ' 84' ' ' LEU . . . -95.08 101.62 2.74 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.519 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.1 m -155.72 61.19 0.6 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.34 0.591 . . . . 0.0 110.079 178.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.423 ' H ' ' N ' ' A' ' 87' ' ' GLY . . . 73.83 173.1 27.16 Favored Glycine 0 N--CA 1.452 -0.285 0 CA-C-N 115.414 -0.812 . . . . 0.0 112.688 179.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 68.68 -124.6 18.43 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.169 -0.539 . . . . 0.0 112.476 178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -122.02 142.65 50.12 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 177.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 12.1 p -109.58 147.57 13.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.657 -179.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.5 mtm -65.51 106.98 1.55 Allowed 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.05 177.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -63.23 104.8 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.631 -174.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.531 ' H ' ' HG3' ' A' ' 82' ' ' PRO . 11.8 p -91.22 38.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-O 122.223 1.011 . . . . 0.0 109.933 178.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 89.89 -60.13 3.52 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.506 -177.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -154.52 83.18 4.09 Favored Pre-proline 0 C--N 1.321 -0.663 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 177.629 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.531 ' HG3' ' H ' ' A' ' 79' ' ' VAL . 4.6 Cg_exo -78.93 148.42 22.06 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.526 2.151 . . . . 0.0 112.762 -175.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -84.54 -9.21 58.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.624 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.715 ' HB3' ' CD1' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -118.12 99.7 7.05 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.27 -178.588 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 8.1 ttt -91.78 -42.05 10.33 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 175.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -125.73 -160.41 10.64 Favored Glycine 0 N--CA 1.441 -1.003 0 N-CA-C 109.998 -1.241 . . . . 0.0 109.998 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.423 ' N ' ' H ' ' A' ' 73' ' ' GLY . . . -70.79 -39.32 65.75 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.181 -1.009 . . . . 0.0 111.31 175.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -82.86 55.43 3.05 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.693 -0.253 . . . . 0.0 111.184 -178.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.715 ' CD1' ' HB3' ' A' ' 84' ' ' LEU . 2.1 m-85 -26.07 -73.6 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.397 1.079 . . . . 0.0 112.714 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -117.74 87.16 0.42 Allowed Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 114.595 -1.184 . . . . 0.0 110.545 176.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.401 ' HB2' ' CG ' ' A' ' 94' ' ' GLU . 0.4 OUTLIER -71.1 -99.65 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.522 -0.339 . . . . 0.0 110.396 -176.179 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 67.09 -42.46 0.43 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.058 0.943 . . . . 0.0 113.499 174.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -107.27 35.24 3.12 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-O 120.956 0.408 . . . . 0.0 111.252 -173.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.401 ' CG ' ' HB2' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -108.68 138.4 45.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.126 0.489 . . . . 0.0 111.216 -177.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.569 ' H ' ' HE1' ' A' ' 49' ' ' TYR . 2.4 ttt85 -97.25 -2.02 43.59 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.797 176.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.881 HD22 ' HB3' ' A' ' 46' ' ' ARG . 11.9 mt 59.43 -159.33 0.3 Allowed 'General case' 0 N--CA 1.461 0.09 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.866 -178.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.856 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -161.58 128.16 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 175.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.74 122.64 33.66 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.454 -175.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.58 ' HD3' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -71.81 92.73 1.25 Allowed 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 173.71 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.573 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -102.6 170.35 8.09 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.918 0.866 . . . . 0.0 111.93 -170.436 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.47 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -101.74 137.89 39.45 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 113.597 -1.638 . . . . 0.0 110.044 179.602 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -92.7 156.98 16.7 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.977 0.417 . . . . 0.0 110.979 -178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 16.7 m -43.74 -55.88 4.15 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.098 -0.956 . . . . 0.0 113.185 -177.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.95 -4.73 4.86 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -172.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.433 ' CD2' ' HB2' ' A' ' 16' ' ' ARG . 0.3 OUTLIER -126.01 -135.65 0.26 Allowed 'General case' 0 N--CA 1.445 -0.722 0 O-C-N 121.965 -0.459 . . . . 0.0 110.142 178.552 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.47 ' O ' ' HB3' ' A' ' 101' ' ' GLU . 11.0 t70 -178.05 -77.37 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.419 -0.809 . . . . 0.0 109.728 178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.402 ' H ' ' HB3' ' A' ' 106' ' ' ASP . . . 51.71 33.53 11.19 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.281 -0.872 . . . . 0.0 112.034 178.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -135.28 -59.73 0.77 Allowed 'General case' 0 C--N 1.328 -0.349 0 C-N-CA 121.063 -0.255 . . . . 0.0 111.459 -179.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -137.45 -16.03 1.39 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.811 0.339 . . . . 0.0 111.555 -177.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -82.45 -166.85 39.25 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.658 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 1.1 mp -93.12 -13.84 8.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.356 0.598 . . . . 0.0 110.192 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.77 65.95 4.13 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.197 177.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -108.99 143.49 38.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.307 -176.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.35 -0.833 . . . . 0.0 110.256 -179.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.614 0 N-CA-C 112.2 -0.36 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.55 120.13 16.69 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.734 0.302 . . . . 0.0 110.366 178.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.3 mt -72.79 170.33 14.86 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.887 -178.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.473 ' CB ' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -111.56 161.6 16.02 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 176.176 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.439 ' HB ' ' OE1' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -141.09 134.22 29.39 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.246 -0.649 . . . . 0.0 109.246 178.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.688 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -85.29 164.26 18.12 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.919 -173.794 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -93.43 -1.52 66.35 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.337 -177.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -93.04 -51.51 2.24 Favored Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 121.074 -0.584 . . . . 0.0 111.982 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 18.1 p -109.04 -33.39 6.91 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.609 0.242 . . . . 0.0 110.514 178.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' ' 6' ' ' CYS . 0.0 OUTLIER 69.33 21.3 7.05 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.586 -0.733 . . . . 0.0 111.957 178.18 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.552 ' HG3' ' H ' ' A' ' 12' ' ' ASN . 0.0 OUTLIER -76.26 -55.08 5.89 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 120.376 -0.53 . . . . 0.0 111.765 -177.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.552 ' H ' ' HG3' ' A' ' 11' ' ' GLN . 24.3 t30 160.17 128.09 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 123.254 0.622 . . . . 0.0 109.868 -176.497 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.473 HD12 ' CB ' ' A' ' 4' ' ' LEU . 2.0 mt -99.21 101.42 12.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 120.863 0.363 . . . . 0.0 110.4 174.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -113.88 16.21 20.96 Favored Glycine 0 N--CA 1.446 -0.693 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 -179.768 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 -78.91 165.67 23.24 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.482 -0.359 . . . . 0.0 110.122 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.558 ' HB2' ' HD1' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -84.81 -30.87 24.2 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.688 179.823 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.641 ' HE2' ' HB3' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -122.22 137.99 54.64 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 173.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.7 p90 -150.74 -172.87 4.31 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 120.725 -0.39 . . . . 0.0 111.08 -177.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.74 HD22 HD13 ' A' ' 97' ' ' ILE . 16.4 mt -126.59 127.46 45.28 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.637 -175.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.982 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -162.37 144.68 11.02 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.453 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -178.61 -51.55 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.722 HD13 ' HG2' ' A' ' 54' ' ' LYS . 40.0 mt -44.58 -60.95 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.319 0 CA-C-N 115.459 -0.791 . . . . 0.0 112.271 -175.021 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.463 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 22.0 t70 168.68 33.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -162.1 161.6 28.27 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 113.298 -1.773 . . . . 0.0 108.281 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.982 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 4.7 m-85 -99.15 144.91 27.75 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 167.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.577 ' HA ' ' HB2' ' A' ' 6' ' ' CYS . 84.2 m95 -128.5 -166.76 1.67 Allowed 'General case' 0 C--N 1.311 -1.083 0 CA-C-O 121.629 0.728 . . . . 0.0 111.242 -174.549 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.5 m170 -126.24 157.17 38.96 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.552 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.561 ' HA ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -61.02 -38.0 84.54 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 123.585 0.553 . . . . 0.0 111.77 -178.863 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -115.67 -2.64 12.41 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.313 0.578 . . . . 0.0 112.033 -172.156 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.6 m -79.54 -44.15 21.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -177.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.414 HD13 ' CD1' ' A' ' 97' ' ' ILE . 1.1 mt -55.3 113.95 1.61 Allowed 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.353 0.596 . . . . 0.0 112.125 -175.063 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.793 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -145.57 -157.66 0.82 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.702 176.726 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 1.035 ' HB2' ' H ' ' A' ' 38' ' ' CYS . 0.5 OUTLIER -50.93 129.59 23.79 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 123.389 0.431 . . . . 0.0 110.391 176.597 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.405 ' HB2' ' NE ' ' A' ' 95' ' ' ARG . 17.1 t70 -73.14 -58.44 3.32 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.269 0.557 . . . . 0.0 110.75 -179.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.0 tp -73.51 -36.91 65.79 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.556 -175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.589 ' HB2' ' SG ' ' A' ' 38' ' ' CYS . 0.2 OUTLIER -105.9 -24.69 12.39 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 113.359 0.874 . . . . 0.0 113.359 -167.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.531 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 68.21 45.92 67.83 Favored Glycine 0 CA--C 1.523 0.57 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.784 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 1.035 ' H ' ' HB2' ' A' ' 33' ' ' CYS . 0.0 OUTLIER -107.38 -89.32 0.45 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 117.134 0.467 . . . . 0.0 110.823 178.083 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.413 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 2.3 tpt180 -158.8 169.06 25.21 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.549 0.214 . . . . 0.0 110.92 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.793 ' HG ' ' HA ' ' A' ' 32' ' ' SER . 79.9 mt -109.1 -85.73 0.53 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.824 0.345 . . . . 0.0 110.712 178.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 131.22 -34.12 2.67 Favored Glycine 0 N--CA 1.45 -0.419 0 N-CA-C 111.004 -0.839 . . . . 0.0 111.004 -177.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.502 ' H ' ' CB ' ' A' ' 93' ' ' ASP . 0.6 OUTLIER 50.26 51.71 16.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.43 0.692 . . . . 0.0 111.873 173.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 m -140.85 9.54 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.581 ' HA3' ' HA ' ' A' ' 91' ' ' ASP . . . -78.51 7.34 48.36 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.293 -0.955 . . . . 0.0 111.968 178.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 44' ' ' GLY . 0.3 OUTLIER 166.96 -85.95 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 176.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.502 ' O ' ' HB2' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -134.38 3.6 3.36 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.968 -1.469 . . . . 0.0 107.962 158.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.841 ' HB3' ' HB2' ' A' ' 96' ' ' LEU . 0.2 OUTLIER 155.92 -171.62 0.0 OUTLIER 'General case' 0 C--N 1.344 0.361 0 CA-C-N 113.917 -1.492 . . . . 0.0 108.876 174.332 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.854 ' HD2' ' HG3' ' A' ' 94' ' ' GLU . 1.4 t80 -159.05 147.21 17.93 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 177.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.839 ' HB3' ' H ' ' A' ' 96' ' ' LEU . 0.1 OUTLIER -165.08 155.09 13.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 171.287 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -74.87 162.99 28.14 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -175.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.637 ' HG ' ' N ' ' A' ' 52' ' ' GLY . 2.3 pt? -28.33 -53.3 0.1 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.987 0.915 . . . . 0.0 113.162 -174.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.637 ' N ' ' HG ' ' A' ' 51' ' ' LEU . . . -144.0 34.77 1.64 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.369 -1.092 . . . . 0.0 110.369 173.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -137.7 112.58 8.99 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 115.312 -0.444 . . . . 0.0 110.694 -173.371 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.722 ' HG2' HD13 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -83.77 99.46 10.3 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 174.392 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.871 ' O ' ' HB3' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -150.12 151.6 33.41 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 -177.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -63.66 136.97 57.89 Favored 'General case' 0 CA--C 1.506 -0.719 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.896 -175.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.575 ' HB2' ' HB2' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -76.17 -35.29 59.21 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.692 -177.446 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.716 ' HB3' ' HA2' ' A' ' 64' ' ' GLY . 3.6 mmt85 -75.48 -42.15 53.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.194 -179.448 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.563 ' HA ' ' O ' ' A' ' 62' ' ' ARG . 14.9 m-20 -81.94 -4.1 55.84 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 120.77 -0.372 . . . . 0.0 110.191 176.025 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' ARG . 0.1 OUTLIER -78.08 -44.17 27.01 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 170.631 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -56.17 12.62 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.172 176.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.7 ' HB2' ' HB3' ' A' ' 66' ' ' SER . 10.9 tpp180 -163.71 -80.47 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.702 -1.136 . . . . 0.0 108.04 169.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.413 ' H ' ' HB3' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -127.62 -29.15 2.67 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.043 168.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.716 ' HA2' ' HB3' ' A' ' 58' ' ' ARG . . . -135.07 -66.04 0.07 OUTLIER Glycine 0 N--CA 1.435 -1.424 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.757 175.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -145.58 21.55 1.85 Allowed Glycine 0 CA--C 1.518 0.229 0 C-N-CA 120.018 -1.087 . . . . 0.0 114.425 -176.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.7 ' HB3' ' HB2' ' A' ' 62' ' ' ARG . 0.1 OUTLIER 26.62 43.95 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 113.835 1.05 . . . . 0.0 113.835 -175.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -108.78 42.28 1.99 Allowed Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 121.215 -0.517 . . . . 0.0 112.306 -176.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -60.56 -24.29 61.69 Favored Glycine 0 N--CA 1.452 -0.241 0 C-N-CA 121.443 -0.408 . . . . 0.0 112.939 -177.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -63.64 -85.82 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.612 0.72 . . . . 0.0 111.258 179.28 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 12.7 mtp -68.14 -38.45 82.19 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.876 -1.057 . . . . 0.0 111.007 -177.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 126.2 -45.79 1.13 Allowed Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 121.003 -0.618 . . . . 0.0 112.12 179.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -130.85 123.68 29.57 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.528 0.204 . . . . 0.0 110.513 -178.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.634 ' HA2' ' HA2' ' A' ' 87' ' ' GLY . . . 93.49 -167.38 28.64 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.742 -0.742 . . . . 0.0 113.355 179.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 145.95 -8.59 1.51 Allowed Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.105 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -136.81 139.36 41.71 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 117.526 0.663 . . . . 0.0 111.352 -178.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.0 t -77.82 124.88 36.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.101 -179.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.516 ' HG2' ' O ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -70.26 113.63 7.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.137 178.452 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.3 m -117.43 -0.37 8.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.626 -176.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 1.6 t -110.87 -27.8 2.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.277 0.56 . . . . 0.0 110.42 -179.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 125.74 24.17 1.57 Allowed Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.886 -0.673 . . . . 0.0 111.712 -178.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.501 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.9 mp0 -75.25 135.8 72.74 Favored Pre-proline 0 C--N 1.321 -0.658 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 5.3 Cg_exo -80.39 147.97 18.33 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 122.242 1.961 . . . . 0.0 112.143 -177.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 88' ' ' GLU . 0.2 OUTLIER -75.21 98.03 3.65 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.161 178.694 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.1 mt -88.59 -179.16 5.99 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.914 178.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.74 -38.49 64.75 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.92 0.39 . . . . 0.0 110.519 -179.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.14 70.67 0.55 Allowed Glycine 0 N--CA 1.446 -0.688 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.893 178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.634 ' HA2' ' HA2' ' A' ' 73' ' ' GLY . . . 96.01 158.25 32.02 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.348 -177.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.516 ' O ' ' HG2' ' A' ' 77' ' ' MET . 3.0 mp0 -83.09 31.41 0.44 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.901 0.381 . . . . 0.0 111.94 -176.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.504 ' CE2' ' HA3' ' A' ' 87' ' ' GLY . 0.0 OUTLIER -122.87 152.53 40.68 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.299 -177.72 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -138.11 80.49 0.29 Allowed Glycine 0 N--CA 1.447 -0.579 0 N-CA-C 110.966 -0.853 . . . . 0.0 110.966 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.581 ' HA ' ' HA3' ' A' ' 44' ' ' GLY . 0.1 OUTLIER -147.75 -85.87 0.1 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.16 -0.52 . . . . 0.0 110.069 -171.9 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.679 ' HA ' ' HG2' ' A' ' 58' ' ' ARG . 1.9 mp0 72.67 -16.03 0.47 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.708 0.803 . . . . 0.0 112.502 175.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.517 ' HB2' ' HB3' ' A' ' 40' ' ' LEU . 1.9 p30 -115.08 34.27 4.95 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.214 0.449 . . . . 0.0 112.214 -174.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.871 ' HB3' ' O ' ' A' ' 55' ' ' LEU . 0.1 OUTLIER -64.19 101.64 0.43 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 113.437 0.902 . . . . 0.0 113.437 -173.355 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.531 ' HG3' ' HB2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER 179.51 45.58 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.552 0 C-N-CA 125.191 1.396 . . . . 0.0 108.639 176.056 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.841 ' HB2' ' HB3' ' A' ' 47' ' ' LEU . 0.4 OUTLIER -70.29 147.21 49.94 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 113.537 0.94 . . . . 0.0 113.537 -165.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.74 HD13 HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -143.88 -162.93 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.885 0 CA-C-N 113.936 -1.484 . . . . 0.0 108.51 -179.198 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -142.06 138.54 31.82 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 176.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.641 ' HB3' ' HE2' ' A' ' 17' ' ' TYR . 6.8 mmm180 -69.12 108.85 3.75 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.946 -0.57 . . . . 0.0 109.684 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.586 HD13 ' HD3' ' A' ' 20' ' ' LYS . 0.2 OUTLIER -105.65 170.92 7.62 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.378 0.609 . . . . 0.0 110.99 -176.837 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.76 138.09 54.73 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.097 -179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -77.11 177.36 7.89 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.558 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 15.4 m -56.88 -65.82 0.55 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.609 -178.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 6.9 mm100 -84.37 54.19 2.9 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.213 0.53 . . . . 0.0 111.594 -176.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.558 ' HD1' ' HB2' ' A' ' 16' ' ' ARG . 57.3 t80 -126.64 -33.83 2.49 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.285 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.435 ' O ' ' HB3' ' A' ' 107' ' ' ALA . 0.2 OUTLIER -44.83 -33.16 1.82 Allowed 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.478 -177.59 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.508 ' HA ' ' HB2' ' A' ' 113' ' ' ASP . . . 100.25 51.97 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.54 0 O-C-N 125.24 1.587 . . . . 0.0 109.94 -179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -91.44 -25.58 19.26 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.194 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -97.1 -20.25 18.12 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.788 -178.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -174.85 -146.4 5.72 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.122 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -92.27 -39.53 11.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 121.027 0.442 . . . . 0.0 109.996 177.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -108.61 87.25 2.45 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 170.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.508 ' HB2' ' HA ' ' A' ' 107' ' ' ALA . 6.2 t0 -53.33 138.73 31.94 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.396 -1.275 . . . . 0.0 112.788 -169.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 0.977 0 CA-C-O 117.878 -1.058 . . . . 0.0 109.044 178.304 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.826 0 N-CA-C 111.981 -0.448 . . . . 0.0 111.981 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.83 -165.54 0.84 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.845 0.355 . . . . 0.0 111.108 -179.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 30.8 mt -99.87 -49.37 4.37 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.713 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.95 151.89 27.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.39 -177.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.45 136.28 48.85 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 114.929 -1.032 . . . . 0.0 109.947 175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -88.86 138.7 31.18 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.763 -174.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.88 -2.57 71.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.834 -176.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.716 ' CA ' ' HG2' ' A' ' 46' ' ' ARG . . . -95.37 -37.08 5.2 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.71 -0.757 . . . . 0.0 113.067 -178.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.61 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.5 p -130.51 -29.24 1.99 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.886 0.343 . . . . 0.0 111.428 -178.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 63.78 25.95 14.26 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 122.897 0.479 . . . . 0.0 111.67 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.61 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 4.1 pt20 -87.78 14.21 9.11 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.599 0.237 . . . . 0.0 110.772 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 11' ' ' GLN . 1.3 m120 74.32 131.39 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.44 178.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.455 HG23 ' CD2' ' A' ' 27' ' ' HIS . 1.9 mt -98.0 105.7 17.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.203 0.525 . . . . 0.0 111.338 -179.186 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -122.69 32.65 4.38 Favored Glycine 0 N--CA 1.447 -0.595 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.249 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -81.25 -173.74 4.5 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.028 -0.586 . . . . 0.0 110.691 -178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.51 ' HB2' ' HD2' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -99.56 -17.75 17.71 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.26 176.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.646 ' HE1' ' HG2' ' A' ' 101' ' ' GLU . 0.3 OUTLIER -156.08 145.4 20.75 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 178.778 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -153.27 -170.82 3.72 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.77 -174.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.512 ' HG ' ' HD2' ' A' ' 99' ' ' ARG . 5.1 mt -124.71 131.02 53.49 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.682 179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.954 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.82 139.5 8.83 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 175.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.753 ' HB3' ' HA ' ' A' ' 97' ' ' ILE . . . 172.72 -37.19 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 O-C-N 123.611 0.57 . . . . 0.0 111.687 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.579 HD12 ' CD1' ' A' ' 47' ' ' LEU . 0.5 OUTLIER -49.39 -56.55 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.279 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.409 -174.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 20.4 t70 179.47 21.08 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.111 176.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -174.01 -177.82 1.4 Allowed 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 114.984 -1.007 . . . . 0.0 108.973 -178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.954 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 3.0 m-85 -99.64 150.68 22.02 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.323 -0.399 . . . . 0.0 109.952 178.42 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.543 ' CZ3' ' HA ' ' A' ' 46' ' ' ARG . 82.5 m95 -133.01 -158.62 0.9 Allowed 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.507 0.67 . . . . 0.0 110.957 -176.521 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.4 m80 -128.75 154.69 46.12 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.66 -1.154 . . . . 0.0 109.452 175.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' HG3' ' HA ' ' A' ' 18' ' ' PHE . 2.6 mt-10 -63.95 -35.79 81.83 Favored 'General case' 0 C--N 1.321 -0.667 0 O-C-N 123.38 0.425 . . . . 0.0 110.649 178.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -107.68 3.17 24.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.918 -177.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 1.04 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.1 m -86.34 -37.79 18.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.192 0.52 . . . . 0.0 109.767 175.309 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.573 ' HB3' ' CD1' ' A' ' 48' ' ' TYR . 4.1 mt -89.1 93.47 9.6 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.929 177.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 1.087 ' H ' HD11 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -137.54 -102.91 0.19 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.221 -0.445 . . . . 0.0 112.182 -178.593 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HA ' ' HB3' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -83.45 107.96 16.29 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.567 0.347 . . . . 0.0 111.72 -178.195 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.478 ' HB3' ' HA ' ' A' ' 55' ' ' LEU . 21.9 t0 -95.02 -49.08 5.7 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.846 0.355 . . . . 0.0 110.829 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 55' ' ' LEU . 0.2 OUTLIER -57.11 -47.52 80.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.561 -178.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.1 m -70.99 -39.51 72.4 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.644 178.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 73.25 10.44 78.53 Favored Glycine 0 N--CA 1.452 -0.272 0 CA-C-N 115.869 -0.605 . . . . 0.0 113.349 174.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 67.9 m -65.43 -59.42 4.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.887 0.344 . . . . 0.0 110.744 -179.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.88 -68.69 0.55 Allowed 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.29 177.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 1.087 HD11 ' H ' ' A' ' 32' ' ' SER . 9.6 mp -48.69 -56.35 8.79 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -174.495 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 87.62 89.71 1.07 Allowed Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 -169.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -80.59 0.56 33.49 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -168.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.9 m -96.91 8.84 6.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 112.356 0.502 . . . . 0.0 112.356 -176.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 157.46 9.8 0.05 OUTLIER Glycine 0 CA--C 1.52 0.402 0 C-N-CA 118.926 -1.607 . . . . 0.0 115.311 173.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -110.63 -97.34 0.41 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 118.695 1.248 . . . . 0.0 112.228 -176.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.729 ' HB2' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -100.93 160.05 14.69 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.511 -171.877 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 1.012 ' HB3' ' HE2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -150.13 143.98 25.41 Favored 'General case' 0 CA--C 1.528 0.106 0 N-CA-C 113.451 0.908 . . . . 0.0 113.451 -179.505 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.573 ' CD1' ' HB3' ' A' ' 31' ' ' LEU . 0.2 OUTLIER -125.83 94.41 4.11 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 166.812 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.846 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -129.28 145.87 51.28 Favored 'General case' 0 C--N 1.313 -1.01 0 C-N-CA 118.179 -1.409 . . . . 0.0 113.641 -162.368 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.543 ' CD ' ' HB2' ' A' ' 53' ' ' ARG . 0.2 OUTLIER -98.45 171.2 8.31 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.155 174.016 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HA ' ' HD2' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -19.82 -61.58 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.576 1.15 . . . . 0.0 113.963 -176.472 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -128.61 15.17 6.03 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.311 -0.947 . . . . 0.0 113.591 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.543 ' HB2' ' CD ' ' A' ' 50' ' ' LYS . 2.0 mtp180 -135.01 114.79 12.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.473 0.636 . . . . 0.0 111.807 -179.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 1.012 ' HE2' ' HB3' ' A' ' 47' ' ' LEU . 5.9 mtpm? -77.49 97.81 5.12 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 171.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.923 ' HB2' ' HB2' ' A' ' 35' ' ' LEU . 0.4 OUTLIER -157.14 153.33 27.55 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.315 0.578 . . . . 0.0 112.513 -177.956 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.648 ' SG ' ' HB3' ' A' ' 35' ' ' LEU . 0.0 OUTLIER -63.54 146.25 54.06 Favored 'General case' 0 C--O 1.22 -0.498 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.083 -176.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.634 ' HD3' ' CD2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -75.27 -55.1 6.05 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.755 -171.958 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -25.62 68.15 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 120.997 0.427 . . . . 0.0 110.541 179.129 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.17 -38.76 24.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.503 178.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.642 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -60.32 -34.56 73.99 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.531 175.628 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.741 ' HG ' ' HA ' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -76.12 -9.54 58.7 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.386 -177.595 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.489 ' HA ' ' NE ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -110.15 -52.58 2.76 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.242 176.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.61 ' HG ' ' N ' ' A' ' 64' ' ' GLY . 0.0 OUTLIER -73.9 -39.95 63.51 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 179.747 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.61 ' N ' ' HG ' ' A' ' 63' ' ' LEU . . . -83.22 -19.55 62.4 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 175.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -80.38 41.55 2.49 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 174.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -68.87 5.36 1.14 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.694 0.627 . . . . 0.0 112.694 -172.53 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -78.55 12.39 21.52 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.757 -0.735 . . . . 0.0 111.944 174.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.59 -108.68 2.56 Favored Glycine 0 N--CA 1.448 -0.554 0 N-CA-C 111.456 -0.658 . . . . 0.0 111.456 -178.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -128.34 142.14 51.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.258 0.551 . . . . 0.0 109.946 172.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.543 ' HG3' ' N ' ' A' ' 71' ' ' GLY . 0.0 OUTLIER -112.1 -32.14 6.66 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.992 -1.004 . . . . 0.0 108.628 177.646 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.543 ' N ' ' HG3' ' A' ' 70' ' ' MET . . . 130.31 37.05 0.35 Allowed Glycine 0 N--CA 1.445 -0.754 0 CA-C-N 113.464 -1.698 . . . . 0.0 110.773 -174.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.644 ' HB2' ' HB2' ' A' ' 88' ' ' GLU . 0.0 OUTLIER -112.93 -158.06 0.64 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.352 -0.424 . . . . 0.0 110.604 -175.665 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.17 -92.61 0.8 Allowed Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.575 179.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 80.02 -103.66 2.15 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 -176.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -110.92 95.99 5.88 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 172.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.6 t -130.58 136.11 59.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 115.362 -0.835 . . . . 0.0 109.755 -176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mtm -68.94 99.17 1.02 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.932 0.396 . . . . 0.0 110.574 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.8 m -112.94 -177.92 0.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.274 -178.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 5.5 p -80.34 -13.14 12.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.077 -179.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 169.46 -69.48 0.15 Allowed Glycine 0 N--CA 1.448 -0.516 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.359 177.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 11.0 mm-40 -97.26 146.11 30.78 Favored Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 110.379 -0.23 . . . . 0.0 110.379 179.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.8 Cg_exo -74.82 148.55 36.3 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.433 2.089 . . . . 0.0 111.413 178.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.31 166.37 11.35 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.542 -177.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 8.4 mt -70.37 98.64 1.44 Allowed 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -114.92 34.92 4.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.091 -173.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.38 -37.48 3.66 Favored Glycine 0 N--CA 1.45 -0.372 0 N-CA-C 111.333 -0.707 . . . . 0.0 111.333 -177.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.7 -164.39 31.99 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 177.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.741 ' HA ' ' HG ' ' A' ' 61' ' ' LEU . 33.4 mt-10 38.36 80.09 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 123.627 0.771 . . . . 0.0 113.053 174.637 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -101.0 -147.32 0.36 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.611 177.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -92.07 -85.68 1.5 Allowed Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 110.503 -1.039 . . . . 0.0 110.503 174.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.546 ' HA ' ' HG3' ' A' ' 57' ' ' ARG . 0.2 OUTLIER -124.57 -118.02 0.28 Allowed 'General case' 0 N--CA 1.435 -1.196 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 174.775 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 62.88 -6.35 0.17 Allowed 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.432 0.693 . . . . 0.0 112.291 179.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.578 ' HB3' ' HD2' ' A' ' 57' ' ' ARG . 18.9 t70 -92.94 -11.08 34.23 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.582 -175.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.405 ' HG3' HG13 ' A' ' 97' ' ' ILE . 10.5 pm0 -52.13 142.13 17.03 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.077 179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.482 ' HD2' ' HA ' ' A' ' 51' ' ' LEU . 2.5 ttp85 -55.17 -77.35 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.516 -0.765 . . . . 0.0 112.039 -173.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.547 ' O ' HG12 ' A' ' 22' ' ' ILE . 0.0 OUTLIER -128.52 85.73 2.37 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.457 -175.49 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.753 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -157.42 125.96 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 121.216 0.531 . . . . 0.0 110.731 172.661 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -113.34 138.17 50.44 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.069 179.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.512 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 44.4 mmm-85 -72.28 93.6 1.5 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.021 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -103.27 174.97 5.63 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.721 -167.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.646 ' HG2' ' HE1' ' A' ' 17' ' ' TYR . 15.8 mt-10 -91.57 128.47 37.41 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.702 -1.135 . . . . 0.0 109.254 176.367 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 13.1 t30 -48.12 -69.94 0.11 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 123.607 0.567 . . . . 0.0 112.014 -172.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' A' ' 104' ' ' GLN . 0.2 OUTLIER -136.09 -87.66 0.33 Allowed 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.727 -0.215 . . . . 0.0 111.171 178.059 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . 0.434 ' H ' ' HB ' ' A' ' 103' ' ' THR . 2.5 mt-30 -136.0 44.77 2.44 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.575 -177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.51 ' HD2' ' HB2' ' A' ' 16' ' ' ARG . 0.8 OUTLIER -76.88 65.18 2.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.458 0.647 . . . . 0.0 109.893 176.231 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -71.12 -61.12 1.88 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.993 -179.432 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.806 ' HB3' ' HA ' ' A' ' 114' ' ' GLU . . . -131.13 -51.83 1.03 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.393 175.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . 0.835 ' HB3' ' HB3' ' A' ' 113' ' ' ASP . . . -103.66 148.0 26.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.269 175.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -88.25 45.13 1.25 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.281 -174.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -103.61 -123.76 5.32 Favored Glycine 0 C--N 1.321 -0.284 0 C-N-CA 120.453 -0.879 . . . . 0.0 111.057 174.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.405 ' HB ' ' H ' ' A' ' 112' ' ' ASP . 2.1 mt -88.82 -100.27 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.319 -0.73 0 N-CA-C 108.18 -1.044 . . . . 0.0 108.18 169.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.405 ' H ' ' HB ' ' A' ' 111' ' ' ILE . 13.0 t0 -107.79 77.76 1.15 Allowed 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 169.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.835 ' HB3' ' HB3' ' A' ' 108' ' ' ALA . 12.1 t0 -115.45 150.72 36.02 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.863 -177.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.806 ' HA ' ' HB3' ' A' ' 107' ' ' ALA . 1.0 OUTLIER . . . . . 0 C--N 1.316 -0.857 0 CA-C-O 118.885 -0.578 . . . . 0.0 109.656 179.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.532 ' HA2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.745 -0.542 . . . . 0.0 111.745 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.59 -35.32 79.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.023 0.439 . . . . 0.0 111.06 -177.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.569 HD13 ' HA2' ' A' ' 14' ' ' GLY . 1.5 mp -121.14 -105.11 0.38 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.967 178.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.507 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.5 OUTLIER -97.35 167.69 10.86 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 109.772 -0.455 . . . . 0.0 109.772 175.594 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.95 131.04 38.55 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 176.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.549 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -92.12 152.07 20.1 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.614 -174.428 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -86.79 -0.72 85.72 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.498 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.421 ' N ' ' SG ' ' A' ' 6' ' ' CYS . . . -88.86 -38.12 7.04 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.149 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 28.5 p -126.4 -27.61 3.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.767 0.317 . . . . 0.0 111.052 179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.41 ' HA ' ' O ' ' A' ' 6' ' ' CYS . 8.1 mm-40 62.36 25.2 15.04 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.642 -179.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.584 ' HG3' ' N ' ' A' ' 12' ' ' ASN . 0.7 OUTLIER -83.58 -36.55 23.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 119.167 -0.445 . . . . 0.0 111.466 -177.604 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.584 ' N ' ' HG3' ' A' ' 11' ' ' GLN . 10.8 t30 130.93 129.4 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.569 1.548 . . . . 0.0 109.405 -177.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.507 HD12 ' HB2' ' A' ' 4' ' ' LEU . 6.7 mt -91.86 105.93 17.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.035 0.445 . . . . 0.0 110.756 177.545 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.569 ' HA2' HD13 ' A' ' 3' ' ' LEU . . . -118.99 12.7 11.49 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.602 178.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.69 -173.41 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.307 0.575 . . . . 0.0 110.681 -179.149 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.978 ' HB3' ' HA ' ' A' ' 105' ' ' PHE . 0.0 OUTLIER -90.44 -28.29 18.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.425 177.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -132.33 152.03 51.59 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 178.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 4.1 p90 -153.52 176.34 12.16 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.247 0.546 . . . . 0.0 111.285 179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.88 HD21 ' HD2' ' A' ' 99' ' ' ARG . 13.1 mt -124.74 163.03 22.96 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.22 -177.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.537 ' HG3' ' C ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -156.97 165.08 37.16 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.673 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.657 ' HB2' ' HA ' ' A' ' 97' ' ' ILE . . . 176.53 -80.75 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 174.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.575 HD12 ' HZ2' ' A' ' 26' ' ' TRP . 11.1 mt -43.32 -47.83 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 114.431 -1.258 . . . . 0.0 113.651 -170.296 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 31.6 t70 179.88 -17.81 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.566 0.698 . . . . 0.0 109.86 -178.137 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -129.24 178.49 6.39 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.947 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.549 ' O ' ' HA ' ' A' ' 6' ' ' CYS . 19.5 m-85 -84.26 161.38 20.5 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.303 174.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.575 ' HZ2' HD12 ' A' ' 22' ' ' ILE . 95.9 m95 -136.66 -178.94 5.4 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.275 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.7 m80 -115.63 152.46 33.08 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.624 176.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -66.86 -23.29 66.0 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.574 0.702 . . . . 0.0 110.206 175.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.853 ' HA ' HG13 ' A' ' 43' ' ' VAL . 39.1 t70 -113.41 16.31 18.93 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.39 -176.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 1.049 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 1.3 m -122.87 -33.76 3.31 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -179.358 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.727 ' HA ' ' O ' ' A' ' 46' ' ' ARG . 1.9 tt -90.56 117.66 29.41 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 120.633 -0.427 . . . . 0.0 112.01 -178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.791 ' HB3' ' HA ' ' A' ' 39' ' ' ARG . 1.1 m -175.97 -163.0 0.1 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.436 173.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.742 ' HB3' ' H ' ' A' ' 37' ' ' GLY . 6.0 m -46.67 119.58 2.52 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.431 0.693 . . . . 0.0 112.674 -175.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -97.55 -36.87 10.16 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 173.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.594 ' HB3' ' SG ' ' A' ' 56' ' ' CYS . 3.3 tp -67.49 -54.82 16.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.95 -1.023 . . . . 0.0 110.651 178.23 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.3 m -83.04 -49.28 9.72 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.025 0.44 . . . . 0.0 111.119 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.742 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 102.93 6.89 45.31 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.906 -177.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 7.9 m -89.48 -113.74 0.07 Allowed 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.791 ' HA ' ' HB3' ' A' ' 32' ' ' SER . 0.0 OUTLIER -158.13 152.73 24.79 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.664 0.269 . . . . 0.0 111.288 178.851 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.407 ' H ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -113.66 32.81 5.56 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.635 178.549 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 138.75 -66.32 0.53 Allowed Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 111.244 -0.743 . . . . 0.0 111.244 -177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.537 ' O ' ' HD3' ' A' ' 39' ' ' ARG . 3.1 mm-40 -86.22 -119.45 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.851 0.358 . . . . 0.0 110.038 175.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.853 HG13 ' HA ' ' A' ' 29' ' ' ASP . 1.2 p -158.77 147.13 8.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 178.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.484 ' N ' ' HB2' ' A' ' 32' ' ' SER . . . 160.2 -168.61 35.86 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 119.5 -1.334 . . . . 0.0 113.877 -175.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.836 ' HG2' ' HG2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -132.09 -23.85 2.16 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -175.0 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.836 ' HG2' ' HG2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -124.28 152.48 42.98 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 178.08 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.952 HD21 ' HA ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -154.28 -161.71 1.28 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 117.837 0.29 . . . . 0.0 110.71 -176.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.47 ' CE1' ' HB2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -67.94 144.77 55.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.849 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 2.4 p90 -135.9 165.11 26.41 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 119.101 -1.04 . . . . 0.0 113.123 -169.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.09 170.91 15.82 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.579 177.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.762 HD13 ' H ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -53.48 -19.96 4.26 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -175.237 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -117.85 -37.33 0.9 Allowed Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 120.071 -1.061 . . . . 0.0 114.057 -175.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.7 ptt180 -148.71 158.71 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.827 0.814 . . . . 0.0 112.279 -174.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.849 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 8.4 mttp -77.8 121.36 23.97 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.371 -178.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.806 HD11 ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -160.59 147.78 15.76 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.62 -0.718 . . . . 0.0 109.334 178.083 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.952 ' HA ' HD21 ' A' ' 47' ' ' LEU . 0.0 OUTLIER -66.52 145.04 56.08 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.581 -0.736 . . . . 0.0 112.792 -169.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.531 ' O ' ' HD1' ' A' ' 60' ' ' TYR . 16.8 tpt180 -64.2 -54.12 38.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.094 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.557 ' O ' ' HD2' ' A' ' 62' ' ' ARG . 3.0 mpt_? -72.25 -31.98 66.28 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.934 -176.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.43 ' HB2' ' HB2' ' A' ' 56' ' ' CYS . 30.1 m-20 -76.13 -40.05 53.67 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.818 -0.353 . . . . 0.0 110.832 -178.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.806 ' HB2' HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -65.88 -28.6 69.08 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.153 173.966 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.587 ' O ' ' HA3' ' A' ' 65' ' ' GLY . 0.5 OUTLIER -79.01 -0.54 31.63 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.285 176.251 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.557 ' HD2' ' O ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -105.41 -48.21 3.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.847 0.356 . . . . 0.0 110.822 177.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -83.01 -35.71 25.61 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.463 -179.491 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.96 -20.75 30.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 174.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.587 ' HA3' ' O ' ' A' ' 61' ' ' LEU . . . -88.4 41.34 3.06 Favored Glycine 0 N--CA 1.445 -0.76 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 174.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.83 -11.25 35.22 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 123.63 0.772 . . . . 0.0 112.996 -173.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.455 ' HA3' ' HB2' ' A' ' 72' ' ' SER . . . -76.07 -24.72 68.27 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.766 -0.731 . . . . 0.0 112.657 -177.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.74 -16.97 43.08 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.275 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.453 ' HB3' ' H ' ' A' ' 70' ' ' MET . 0.4 OUTLIER -88.94 -132.94 0.09 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 177.801 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.489 ' HB3' ' HG2' ' A' ' 85' ' ' MET . 0.0 OUTLIER -65.91 -30.29 70.85 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.203 0.525 . . . . 0.0 109.772 176.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -179.14 -63.92 0.07 OUTLIER Glycine 0 N--CA 1.444 -0.831 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.892 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.455 ' HB2' ' HA3' ' A' ' 67' ' ' GLY . 0.3 OUTLIER 41.39 57.78 2.84 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.677 ' O ' ' HA3' ' A' ' 87' ' ' GLY . . . 171.26 -162.53 35.25 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.286 -0.959 . . . . 0.0 112.426 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 82.92 97.03 0.54 Allowed Glycine 0 N--CA 1.444 -0.818 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.445 178.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -95.73 101.8 13.53 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.209 -0.664 . . . . 0.0 109.209 175.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.43 HG23 ' HB2' ' A' ' 88' ' ' GLU . 0.1 OUTLIER -133.66 164.48 34.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.467 -174.616 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.5 mtt -63.35 149.05 46.73 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.89 0.376 . . . . 0.0 110.964 179.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 2.6 t -80.18 103.13 6.76 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.08 178.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.57 ' HB ' HD23 ' A' ' 51' ' ' LEU . 3.5 t -110.92 -37.95 3.17 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.583 -179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 164.74 44.77 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.583 179.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.571 ' HG2' ' HB3' ' A' ' 88' ' ' GLU . 4.7 mp0 -64.25 111.68 6.03 Favored Pre-proline 0 C--N 1.328 -0.342 0 C-N-CA 123.033 0.533 . . . . 0.0 111.413 -175.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.404 ' HD2' ' HA2' ' A' ' 90' ' ' GLY . 3.2 Cg_exo -79.16 -80.09 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.421 0 C-N-CA 123.238 2.625 . . . . 0.0 112.188 -179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -83.44 101.3 11.28 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.887 -176.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.8 mt -91.88 115.09 27.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.248 178.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . 0.489 ' HG2' ' HB3' ' A' ' 70' ' ' MET . 0.0 OUTLIER -106.17 36.13 2.69 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.737 -174.953 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 112.33 -30.78 7.36 Favored Glycine 0 N--CA 1.453 -0.219 0 N-CA-C 111.135 -0.786 . . . . 0.0 111.135 -174.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . 0.677 ' HA3' ' O ' ' A' ' 73' ' ' GLY . . . -129.54 -161.96 10.7 Favored Glycine 0 N--CA 1.446 -0.677 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 175.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.571 ' HB3' ' HG2' ' A' ' 81' ' ' GLU . 22.1 mt-10 -102.42 83.65 2.34 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.632 0.73 . . . . 0.0 112.015 -175.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.731 ' HB3' ' OH ' ' A' ' 60' ' ' TYR . 17.0 m-85 -102.73 -173.27 2.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.896 -177.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.404 ' HA2' ' HD2' ' A' ' 82' ' ' PRO . . . -106.26 -100.2 2.64 Favored Glycine 0 N--CA 1.44 -1.045 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.014 179.206 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 92' ' ' GLU . 3.3 p-10 -107.78 -120.85 0.25 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.078 0.466 . . . . 0.0 111.164 -174.234 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 91' ' ' ASP . 3.3 mm-40 -153.08 -50.47 0.1 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.947 -1.024 . . . . 0.0 109.191 178.75 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -142.66 -31.04 0.52 Allowed 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.979 -1.01 . . . . 0.0 110.529 177.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.45 ' HB3' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER 59.87 -102.7 0.14 Allowed 'General case' 0 C--O 1.233 0.186 0 O-C-N 123.352 0.407 . . . . 0.0 110.185 -178.186 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.557 ' HB3' ' HB1' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -121.0 -14.31 8.45 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.583 176.543 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.434 ' C ' HG13 ' A' ' 97' ' ' ILE . 30.4 mt 49.39 -106.98 0.22 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.662 0.601 . . . . 0.0 110.853 -178.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.739 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -159.82 132.98 1.2 Allowed 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.5 174.581 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -108.39 125.49 51.81 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.88 ' HD2' HD21 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -92.29 135.21 34.2 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.057 -0.349 . . . . 0.0 110.057 -176.859 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -134.52 173.13 11.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.081 0.467 . . . . 0.0 110.701 -179.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.79 141.52 40.7 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.096 -0.957 . . . . 0.0 109.875 175.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.423 HD21 HD22 ' A' ' 3' ' ' LEU . 49.8 t30 -66.86 -54.74 19.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 92.4 m -161.52 -61.54 0.05 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.031 174.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.73 -68.21 0.38 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.038 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.978 ' HA ' ' HB3' ' A' ' 16' ' ' ARG . 1.8 m-85 -143.8 -128.83 0.08 Allowed 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 -179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' H ' ' HB3' ' A' ' 105' ' ' PHE . 42.3 t0 -115.86 -68.27 0.93 Allowed 'General case' 0 C--N 1.311 -1.091 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 167.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -163.53 22.33 0.08 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.179 -1.373 . . . . 0.0 110.904 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . 69.57 -73.16 0.09 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.349 0.659 . . . . 0.0 110.062 -174.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 31.1 t-20 -94.08 45.07 1.13 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.598 171.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -84.38 -143.17 5.79 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.55 -0.75 . . . . 0.0 112.528 -177.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 2.6 mt -127.78 -31.43 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.13 0.49 . . . . 0.0 110.427 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -105.45 11.52 32.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.665 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.07 171.09 15.36 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.068 178.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.499 -0.762 . . . . 0.0 109.913 178.042 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 112.016 -0.434 . . . . 0.0 112.016 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.2 m -91.97 143.45 26.47 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.94 0.4 . . . . 0.0 111.07 -179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.764 HD13 HD21 ' A' ' 102' ' ' ASN . 0.8 OUTLIER -125.11 -72.98 0.65 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.619 178.473 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 13' ' ' ILE . 0.4 OUTLIER -121.07 161.16 22.19 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 173.474 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.1 133.49 55.22 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.4 177.705 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.696 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -90.09 138.22 31.7 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.989 -178.044 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.26 -2.65 84.12 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.832 -176.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -88.0 -53.58 2.65 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.431 -178.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . . . . . . . . . 32.1 p -107.84 -25.6 11.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.766 0.317 . . . . 0.0 111.135 -178.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 62.55 25.51 15.18 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.34 -179.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.522 ' O ' ' HB3' ' A' ' 12' ' ' ASN . 0.4 OUTLIER -97.23 11.08 37.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.017 -178.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.522 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 5.4 t30 75.43 135.6 0.06 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.242 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.738 HD12 ' HB2' ' A' ' 4' ' ' LEU . 2.6 mt -90.16 102.27 13.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.126 178.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -105.18 9.44 46.2 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.838 -178.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -81.59 -179.49 7.4 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.732 0.301 . . . . 0.0 110.538 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.51 -20.73 16.91 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 120.964 0.411 . . . . 0.0 110.382 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -130.23 139.5 50.79 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 179.8 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 100' ' ' LEU . 2.0 p90 -154.1 -176.1 5.7 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.935 0.398 . . . . 0.0 111.806 -176.425 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.89 HD12 ' HA ' ' A' ' 28' ' ' GLU . 3.0 mt -123.69 136.01 54.21 Favored 'General case' 0 C--O 1.219 -0.538 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.444 179.269 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.867 ' HB2' ' HA ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -161.77 147.22 13.4 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.572 -0.451 . . . . 0.0 109.982 176.57 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.557 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . . . 169.42 -34.53 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 O-C-N 123.646 0.591 . . . . 0.0 111.346 177.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.616 ' HB ' ' HE1' ' A' ' 26' ' ' TRP . 30.5 mt -53.85 -42.72 54.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.602 -174.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.534 ' HB2' ' O ' ' A' ' 22' ' ' ILE . 35.0 t70 159.16 -15.27 0.0 OUTLIER 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 107.413 -1.329 . . . . 0.0 107.413 -178.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.83 175.05 6.07 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-N 113.906 -1.497 . . . . 0.0 109.279 175.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.867 ' HA ' ' HB2' ' A' ' 20' ' ' LYS . 5.2 m-85 -96.04 151.53 19.36 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 167.398 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.616 ' HE1' ' HB ' ' A' ' 22' ' ' ILE . 79.8 m95 -134.52 -168.55 2.17 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-O 121.519 0.676 . . . . 0.0 110.851 -173.206 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 1.9 m80 -121.82 156.2 33.74 Favored 'General case' 0 C--N 1.313 -1.016 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.075 175.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.89 ' HA ' HD12 ' A' ' 19' ' ' LEU . 17.9 mt-10 -62.66 -35.64 80.3 Favored 'General case' 0 C--N 1.321 -0.67 0 O-C-N 123.405 0.44 . . . . 0.0 111.133 178.189 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -106.59 -7.78 17.28 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.267 0.556 . . . . 0.0 111.853 -174.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.888 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 4.9 m -83.6 -49.34 9.29 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.778 178.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.439 HD12 ' CG ' ' A' ' 26' ' ' TRP . 0.9 OUTLIER -62.03 113.53 2.88 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.003 178.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -127.84 173.35 10.05 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.608 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 55' ' ' LEU . 20.0 t -70.49 163.75 26.17 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.505 0.669 . . . . 0.0 111.669 -178.551 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.509 ' OD2' ' HD3' ' A' ' 53' ' ' ARG . 2.4 t70 -105.83 -31.71 8.71 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.7 176.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.89 HD23 ' HB2' ' A' ' 59' ' ' ASP . 27.1 tp -88.09 -60.73 1.89 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.931 -179.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 10.9 m -65.47 -42.3 92.43 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 175.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.547 ' H ' ' HB3' ' A' ' 33' ' ' CYS . . . 84.5 -2.57 87.84 Favored Glycine 0 N--CA 1.449 -0.479 0 CA-C-N 115.203 -0.908 . . . . 0.0 112.984 174.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.56 -83.75 0.17 Allowed 'General case' 0 C--N 1.322 -0.597 0 O-C-N 122.775 -0.25 . . . . 0.0 111.232 -177.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HB3' ' H ' ' A' ' 40' ' ' LEU . 2.8 mtt85 -157.98 -149.07 0.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 110.46 -0.2 . . . . 0.0 110.46 -179.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.464 ' H ' ' HB3' ' A' ' 39' ' ' ARG . 4.4 mt -119.5 77.55 1.23 Allowed 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.597 -0.519 . . . . 0.0 109.597 177.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -107.02 17.62 37.81 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.221 -177.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.537 ' OE1' ' HG2' ' A' ' 58' ' ' ARG . 0.1 OUTLIER -103.07 -158.29 0.66 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 -179.849 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 10.5 t -65.8 105.81 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 176.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -112.56 70.3 0.22 Allowed Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.57 -0.824 . . . . 0.0 113.234 -173.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 45' ' ' ARG . 0.1 OUTLIER -116.16 -39.27 3.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 172.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.578 ' HG3' ' HE1' ' A' ' 48' ' ' TYR . 7.6 ptm180 -137.1 98.32 3.71 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.27 173.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.84 110.71 20.14 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.914 -174.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.578 ' HE1' ' HG3' ' A' ' 46' ' ' ARG . 5.4 m-85 -85.87 97.62 10.31 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.257 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.747 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 12.8 p90 -85.32 150.57 24.67 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 174.159 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.485 ' HG3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -89.45 157.33 18.17 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 120.603 -0.439 . . . . 0.0 109.833 177.526 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.502 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -20.5 -59.56 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.454 1.502 . . . . 0.0 113.895 -176.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.426 ' H ' HD12 ' A' ' 51' ' ' LEU . . . -130.38 24.37 4.44 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.204 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.509 ' HD3' ' OD2' ' A' ' 34' ' ' ASP . 1.1 mtt-85 -138.51 109.22 6.63 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 -179.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.747 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -84.72 112.51 20.55 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.379 178.828 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 60' ' ' TYR . 2.2 pt? -148.8 174.84 11.79 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.404 -175.552 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.777 ' O ' ' HB3' ' A' ' 60' ' ' TYR . 2.4 m -66.13 154.46 39.61 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.492 178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.553 HH11 ' HE1' ' A' ' 60' ' ' TYR . 1.8 tpt180 -72.55 -27.19 62.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.001 179.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.537 ' HG2' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -75.34 -35.61 61.15 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.564 -0.454 . . . . 0.0 112.029 -176.042 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.89 ' HB2' HD23 ' A' ' 35' ' ' LEU . 0.0 OUTLIER -92.09 -23.4 19.47 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 121.985 -0.447 . . . . 0.0 110.038 178.191 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.777 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -69.38 -26.48 64.68 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 115.309 -0.86 . . . . 0.0 108.749 169.056 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.754 HD21 ' HG2' ' A' ' 88' ' ' GLU . 0.3 OUTLIER -58.27 -21.55 49.1 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -176.538 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.465 ' HD2' ' HA ' ' A' ' 62' ' ' ARG . 0.4 OUTLIER -61.55 -29.89 70.3 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 119.64 -0.824 . . . . 0.0 110.195 176.364 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.43 10.18 6.17 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.896 179.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.476 ' CA ' ' HA3' ' A' ' 90' ' ' GLY . . . -141.73 3.64 2.08 Favored Glycine 0 N--CA 1.448 -0.547 0 C-N-CA 120.503 -0.856 . . . . 0.0 113.389 -172.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.716 ' CA ' ' HG ' ' A' ' 61' ' ' LEU . . . -71.46 40.5 0.62 Allowed Glycine 0 CA--C 1.526 0.743 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.626 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.423 ' H ' ' C ' ' A' ' 64' ' ' GLY . 1.0 OUTLIER 26.22 39.98 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.6 1.56 . . . . 0.0 115.172 179.432 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.468 ' HA3' ' O ' ' A' ' 88' ' ' GLU . . . -143.67 -121.51 1.57 Allowed Glycine 0 N--CA 1.448 -0.566 0 N-CA-C 110.897 -0.881 . . . . 0.0 110.897 171.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.59 ' N ' ' HA ' ' A' ' 89' ' ' PHE . . . 63.93 -97.29 0.22 Allowed Glycine 0 CA--C 1.512 -0.101 0 C-N-CA 121.461 -0.4 . . . . 0.0 113.114 172.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -60.63 -46.47 90.16 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.777 0.322 . . . . 0.0 110.727 -178.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -71.0 -24.34 62.37 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.516 -179.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 135.35 -138.89 10.33 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.722 178.673 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 37.6 m -79.25 116.07 19.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.114 0.483 . . . . 0.0 110.516 178.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -100.32 -24.06 9.86 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.467 178.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -178.32 90.51 0.08 OUTLIER Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 111.168 -0.773 . . . . 0.0 111.168 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -82.51 95.28 7.67 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.957 0.408 . . . . 0.0 110.38 -177.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -135.83 159.59 39.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.597 -178.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 15.7 mtm -77.62 131.74 37.93 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.889 179.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 15.6 t 54.97 83.63 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.261 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.638 177.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.15 -16.92 7.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.953 0.406 . . . . 0.0 110.078 177.043 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . 0.438 ' O ' ' HB2' ' A' ' 81' ' ' GLU . . . 119.16 111.61 2.42 Favored Glycine 0 N--CA 1.445 -0.739 0 N-CA-C 111.418 -0.673 . . . . 0.0 111.418 -177.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 80' ' ' GLY . 13.5 mm-40 70.61 156.55 0.16 Allowed Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 122.897 0.479 . . . . 0.0 110.786 -176.61 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -54.38 144.25 62.17 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.285 1.99 . . . . 0.0 112.287 -178.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -101.66 143.95 30.98 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.62 -174.765 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.586 ' H ' ' HE2' ' A' ' 89' ' ' PHE . 7.0 mt -81.41 -176.41 6.0 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 41.9 ttp -54.69 -40.31 69.01 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 120.888 0.375 . . . . 0.0 110.339 -179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.17 134.06 11.88 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 120.52 -0.847 . . . . 0.0 111.036 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -84.65 146.75 22.57 Favored Glycine 0 CA--C 1.506 -0.511 0 N-CA-C 110.545 -1.022 . . . . 0.0 110.545 178.455 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.754 ' HG2' HD21 ' A' ' 61' ' ' LEU . 15.5 mt-10 61.81 110.82 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 123.333 0.653 . . . . 0.0 110.623 -177.486 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.59 ' HA ' ' N ' ' A' ' 68' ' ' GLY . 0.0 OUTLIER -123.61 130.59 52.89 Favored 'General case' 0 CA--C 1.503 -0.839 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.511 -168.767 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.476 ' HA3' ' CA ' ' A' ' 64' ' ' GLY . . . 173.56 -98.73 0.13 Allowed Glycine 0 N--CA 1.435 -1.382 0 C-N-CA 118.664 -1.731 . . . . 0.0 114.427 171.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -117.56 -113.64 0.34 Allowed 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 114.168 -1.016 . . . . 0.0 111.396 -168.057 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.55 -56.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.362 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -136.17 -39.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.458 -179.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 56.87 -150.96 0.43 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.684 -0.689 . . . . 0.0 112.474 175.039 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.478 ' HB3' ' CE1' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -129.27 127.98 42.28 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.389 -179.719 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.404 ' H ' ' HG ' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -115.99 134.74 54.65 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.911 0.386 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.665 HD11 ' HB3' ' A' ' 49' ' ' TYR . 1.1 mt -85.81 153.18 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.659 174.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 4.6 t -148.36 160.04 43.4 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.224 -178.751 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.607 ' HD2' ' HG ' ' A' ' 19' ' ' LEU . 15.9 mmm-85 -81.05 133.21 35.44 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.634 178.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.646 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -123.77 178.68 5.12 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.418 -178.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.43 138.48 52.44 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.215 -179.515 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.764 HD21 HD13 ' A' ' 3' ' ' LEU . 49.3 t30 -110.47 173.44 6.33 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 108.878 175.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.22 106.43 15.0 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 122.656 1.217 . . . . 0.0 111.171 176.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.84 -9.77 1.82 Allowed 'General case' 0 C--N 1.289 -2.059 0 CA-C-N 112.499 -2.137 . . . . 0.0 110.076 176.137 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -123.39 89.06 3.03 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-O 121.587 0.708 . . . . 0.0 109.825 -177.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.33 -38.64 68.59 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.576 -1.193 . . . . 0.0 110.309 -177.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.435 ' H ' ' CG ' ' A' ' 113' ' ' ASP . . . 65.47 57.12 0.91 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.381 -1.281 . . . . 0.0 110.067 -176.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -68.54 -47.24 67.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.121 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 36.3 t30 -117.63 40.8 3.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.509 179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.58 -157.98 17.35 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.256 -179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -73.16 -21.84 19.22 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.983 0.421 . . . . 0.0 110.488 179.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -84.84 66.84 9.88 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 174.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . 0.435 ' CG ' ' H ' ' A' ' 107' ' ' ALA . 34.4 t0 -68.07 161.07 27.61 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.11 -0.95 . . . . 0.0 111.457 -174.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.317 -0.849 . . . . 0.0 109.75 177.481 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.692 0 N-CA-C 112.256 -0.338 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -84.68 164.26 18.72 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.202 0.201 . . . . 0.0 110.471 179.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.465 HD12 ' HA2' ' A' ' 14' ' ' GLY . 5.3 mt -66.48 -78.74 0.05 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.977 0.418 . . . . 0.0 110.439 -179.386 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -128.89 163.19 25.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.736 178.103 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -136.06 129.84 32.55 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 120.991 0.424 . . . . 0.0 111.338 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.515 ' HA ' ' O ' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -86.42 137.12 32.8 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.076 -177.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.425 ' HA3' ' HG3' ' A' ' 24' ' ' GLN . . . -85.5 4.51 85.59 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.505 -176.937 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -96.79 -38.86 4.28 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.295 -178.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' CYS . . . . . 0.625 ' SG ' ' HG2' ' A' ' 11' ' ' GLN . 18.4 p -126.32 -19.26 4.72 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.358 -178.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 62.9 26.53 15.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.109 -0.496 . . . . 0.0 112.249 177.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.625 ' HG2' ' SG ' ' A' ' 9' ' ' CYS . 0.0 OUTLIER -89.49 3.39 52.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 111.689 0.255 . . . . 0.0 111.689 -177.363 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 11' ' ' GLN . 0.5 OUTLIER 73.63 130.93 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.221 0.534 . . . . 0.0 110.534 -178.277 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.423 HG23 ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -100.61 105.79 18.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.538 -179.129 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.465 ' HA2' HD12 ' A' ' 3' ' ' LEU . . . -86.02 -7.0 81.34 Favored Glycine 0 CA--C 1.5 -0.867 0 N-CA-C 111.641 -0.584 . . . . 0.0 111.641 179.216 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -110.98 143.49 41.57 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 177.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.636 ' CD ' ' HA ' ' A' ' 102' ' ' ASN . 0.0 OUTLIER -102.28 25.59 8.74 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.068 175.528 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.816 ' CE1' ' HA ' ' A' ' 101' ' ' GLU . 0.1 OUTLIER -107.18 92.09 3.93 Favored 'General case' 0 CA--C 1.51 -0.592 0 N-CA-C 107.853 -1.166 . . . . 0.0 107.853 167.472 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.648 ' HE2' ' HB3' ' A' ' 25' ' ' TYR . 0.8 OUTLIER -164.84 -167.6 1.27 Allowed 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 114.64 -1.163 . . . . 0.0 111.111 -167.649 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.971 HD22 ' HB ' ' A' ' 97' ' ' ILE . 22.5 mt -123.6 145.51 48.86 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.484 -0.326 . . . . 0.0 111.359 -176.536 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.662 ' HE3' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -146.9 157.7 43.72 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 108.517 -0.919 . . . . 0.0 108.517 172.788 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.499 ' HB2' ' O ' ' A' ' 20' ' ' LYS . . . 163.94 -59.87 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.056 0 O-C-N 123.785 0.678 . . . . 0.0 111.697 173.544 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . 0.785 HG12 ' HG ' ' A' ' 47' ' ' LEU . 1.2 mt -41.79 -45.25 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 114.812 -1.086 . . . . 0.0 113.553 -169.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.475 ' HB2' ' HA3' ' A' ' 44' ' ' GLY . 4.3 t70 178.89 -16.19 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.754 0.788 . . . . 0.0 109.243 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.425 ' HG3' ' HA3' ' A' ' 7' ' ' GLY . 0.9 OUTLIER -148.06 -176.86 5.45 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.669 -1.15 . . . . 0.0 109.589 -177.191 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.648 ' HB3' ' HE2' ' A' ' 18' ' ' PHE . 19.8 m-85 -85.22 158.94 20.21 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.867 ' HH2' ' HA ' ' A' ' 42' ' ' GLU . 87.8 m95 -137.76 -156.86 0.72 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 121.506 0.669 . . . . 0.0 111.106 -176.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 30' ' ' CYS . 2.5 m80 -128.26 173.72 9.9 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.727 -1.124 . . . . 0.0 108.816 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.44 -50.94 33.12 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 120.834 0.35 . . . . 0.0 110.656 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.29 -22.31 33.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.512 0.672 . . . . 0.0 111.196 -177.158 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.925 ' HB2' ' HB2' ' A' ' 27' ' ' HIS . 16.0 m -72.4 -51.15 21.67 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.125 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.802 HD12 HG21 ' A' ' 97' ' ' ILE . 0.1 OUTLIER -97.72 67.67 2.03 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -178.546 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -134.16 152.13 51.68 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 168.446 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.843 ' HA ' HD12 ' A' ' 40' ' ' LEU . 0.0 OUTLIER -68.61 153.11 44.38 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 121.506 0.67 . . . . 0.0 112.156 -169.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -66.5 -37.8 85.85 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.486 -1.234 . . . . 0.0 111.299 -173.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.568 HD23 ' HB3' ' A' ' 59' ' ' ASP . 32.1 tp -74.02 -37.7 64.28 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.845 -179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 5.3 m -56.13 -42.57 77.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.974 0.416 . . . . 0.0 110.341 176.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.13 -3.58 0.48 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 119.99 -1.1 . . . . 0.0 113.75 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 89.4 m -104.88 -125.47 0.22 Allowed 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 117.871 0.836 . . . . 0.0 110.744 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.518 ' CZ ' ' HA ' ' A' ' 30' ' ' CYS . 0.2 OUTLIER -171.7 92.91 0.14 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.357 -176.249 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.843 HD12 ' HA ' ' A' ' 33' ' ' CYS . 0.1 OUTLIER -70.37 93.64 0.88 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.985 0.421 . . . . 0.0 110.563 176.906 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . -101.8 52.57 0.86 Allowed Glycine 0 N--CA 1.449 -0.477 0 N-CA-C 111.266 -0.734 . . . . 0.0 111.266 179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.867 ' HA ' ' HH2' ' A' ' 26' ' ' TRP . 2.9 pp20? -74.56 178.75 5.11 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 112.662 0.615 . . . . 0.0 112.662 -173.122 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 9.3 p -161.57 25.07 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 CA-C-O 122.238 1.018 . . . . 0.0 109.451 -178.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.539 ' HA3' HG22 ' A' ' 22' ' ' ILE . . . -121.07 -167.17 13.2 Favored Glycine 0 N--CA 1.451 -0.343 0 CA-C-N 115.05 -0.977 . . . . 0.0 112.091 -179.571 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -124.54 -37.46 2.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.86 0.33 . . . . 0.0 111.408 -177.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 52.1 mtm-85 -76.87 66.35 2.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -175.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.785 ' HG ' HG12 ' A' ' 22' ' ' ILE . 0.5 OUTLIER -157.49 151.64 24.65 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 175.127 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.672 ' H ' HD22 ' A' ' 47' ' ' LEU . 0.5 OUTLIER -77.75 91.33 4.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-O 121.128 0.49 . . . . 0.0 110.077 178.439 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.882 ' HB2' ' HA ' ' A' ' 54' ' ' LYS . 41.6 p90 -140.47 158.24 44.31 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.405 ' O ' ' HD1' ' A' ' 49' ' ' TYR . 7.8 mttt -76.69 154.46 34.18 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.327 -177.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -36.83 -40.35 0.27 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -176.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -137.63 19.08 3.37 Favored Glycine 0 N--CA 1.445 -0.706 0 C-N-CA 120.225 -0.988 . . . . 0.0 112.712 179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.96 109.07 4.61 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 120.96 0.41 . . . . 0.0 110.491 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.882 ' HA ' ' HB2' ' A' ' 49' ' ' TYR . 0.0 OUTLIER -83.78 101.39 11.56 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.554 -178.5 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.628 ' HA ' ' HB2' ' A' ' 33' ' ' CYS . 1.5 pt? -147.6 164.93 31.94 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 178.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.694 ' SG ' ' HB2' ' A' ' 59' ' ' ASP . 29.3 p -67.25 171.2 6.05 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.664 0.745 . . . . 0.0 111.815 -173.75 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.875 ' HG2' ' HB3' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -73.58 -31.98 63.89 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.691 -1.141 . . . . 0.0 110.873 177.861 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.58 ' HG2' ' SG ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -75.91 -38.97 57.17 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.909 0.385 . . . . 0.0 110.968 -177.221 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.694 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 29.3 m-20 -75.27 -39.98 59.21 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -59.91 -35.02 73.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.415 175.098 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.573 HD12 ' HA3' ' A' ' 65' ' ' GLY . 3.7 tp -69.4 -19.07 63.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.1 -0.5 . . . . 0.0 112.122 -179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -88.67 -19.77 25.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.77 -175.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.43 ' H ' ' HG ' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -122.37 -45.55 2.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -175.404 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -134.98 38.37 1.82 Allowed Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 120.182 -1.009 . . . . 0.0 112.742 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.573 ' HA3' HD12 ' A' ' 61' ' ' LEU . . . -117.81 -104.96 2.28 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.323 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.17 41.29 3.55 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -179.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 28.78 44.04 0.04 OUTLIER Glycine 0 C--N 1.343 0.956 0 O-C-N 124.358 1.036 . . . . 0.0 114.818 -175.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.448 ' O ' ' HG ' ' A' ' 61' ' ' LEU . . . 138.5 -122.03 2.3 Favored Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 -178.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' HIS . . . . . 0.588 ' CG ' ' H ' ' A' ' 70' ' ' MET . 8.4 t-80 -179.96 -147.79 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.588 ' H ' ' CG ' ' A' ' 69' ' ' HIS . 0.4 OUTLIER -103.97 -16.97 15.17 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.361 175.458 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -149.66 107.83 0.37 Allowed Glycine 0 N--CA 1.444 -0.814 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.539 178.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . 0.457 ' HB3' ' HA3' ' A' ' 86' ' ' GLY . 0.1 OUTLIER -93.11 106.59 18.53 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.222 0.209 . . . . 0.0 110.485 -179.084 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -49.23 112.04 1.19 Allowed Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.921 -0.582 . . . . 0.0 112.694 -178.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 167.65 -129.0 1.81 Allowed Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 111.187 -0.765 . . . . 0.0 111.187 -176.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.97 94.83 2.81 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.096 0.474 . . . . 0.0 111.214 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.456 HG12 HG12 ' A' ' 78' ' ' VAL . 15.3 t -131.98 110.45 16.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.52 176.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 78' ' ' VAL . 19.6 mtt -79.43 97.89 6.56 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.805 -176.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.514 HG13 ' HA ' ' A' ' 81' ' ' GLU . 12.9 p 171.46 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.899 179.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 74.1 t -68.32 -41.43 83.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 -179.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.17 60.55 4.83 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.518 -0.764 . . . . 0.0 111.292 173.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.514 ' HA ' HG13 ' A' ' 78' ' ' VAL . 0.7 OUTLIER -53.64 125.75 46.56 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.19 -177.08 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.639 ' HD2' HD21 ' A' ' 84' ' ' LEU . 16.9 Cg_exo -70.2 -170.18 0.4 Allowed 'Trans proline' 0 CA--C 1.529 0.234 0 C-N-CA 122.972 2.448 . . . . 0.0 112.132 -178.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.39 63.66 1.82 Allowed 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.472 -178.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.671 ' H ' HD22 ' A' ' 84' ' ' LEU . 0.8 OUTLIER -70.93 -179.44 2.27 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.633 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -71.72 -46.6 58.11 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 177.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.457 ' HA3' ' HB3' ' A' ' 72' ' ' SER . . . 48.21 -117.15 3.49 Favored Glycine 0 C--N 1.334 0.445 0 CA-C-N 115.671 -0.695 . . . . 0.0 113.37 176.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 151.76 -41.56 0.73 Allowed Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.794 177.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -100.59 102.25 13.35 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 178.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -106.47 -150.12 0.44 Allowed 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.288 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -149.49 94.66 0.16 Allowed Glycine 0 N--CA 1.445 -0.728 0 C-N-CA 121.1 -0.572 . . . . 0.0 111.68 179.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.875 ' HB3' ' HG2' ' A' ' 57' ' ' ARG . 0.0 OUTLIER -68.03 -92.08 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 121.912 0.085 . . . . 0.0 111.061 -177.398 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 49.4 mm-40 67.94 -13.23 0.27 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.24 0.616 . . . . 0.0 112.323 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASP . . . . . 0.439 ' H ' ' C ' ' A' ' 91' ' ' ASP . 13.9 p-10 -77.16 -31.65 55.67 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.259 -176.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.03 156.01 45.89 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 121.059 0.457 . . . . 0.0 110.903 -179.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.23 130.29 39.9 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.551 179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 5.5 mt -101.84 -175.06 2.74 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.734 177.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.971 ' HB ' HD22 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -79.33 135.3 25.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 120.773 0.321 . . . . 0.0 110.406 178.218 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -83.96 115.92 22.55 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.652 -176.601 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.532 ' HD2' ' HA ' ' A' ' 99' ' ' ARG . 0.6 OUTLIER -76.0 93.29 3.25 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 172.523 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.662 HD22 ' HE3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -78.83 171.01 15.79 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.798 -0.361 . . . . 0.0 110.807 -175.231 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.816 ' HA ' ' CE1' ' A' ' 17' ' ' TYR . 5.5 mm-40 -115.63 124.78 51.79 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.583 -0.735 . . . . 0.0 112.594 -171.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.636 ' HA ' ' CD ' ' A' ' 16' ' ' ARG . 48.2 t-20 -77.98 -31.67 50.84 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.914 177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 33.4 m -84.28 -59.66 2.32 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.597 173.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -84.11 46.42 1.2 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.73 -177.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.454 ' HB2' ' HD3' ' A' ' 16' ' ' ARG . 30.2 t80 -83.03 -71.39 0.5 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 174.18 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -158.07 -74.74 0.09 Allowed 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.913 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 51.03 64.3 1.9 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 115.226 -0.897 . . . . 0.0 112.012 173.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -94.81 -149.74 0.3 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.67 179.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -120.81 44.62 2.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.136 0.493 . . . . 0.0 110.804 -179.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLY . . . . . . . . . . . . . . . -144.5 -146.37 4.48 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.794 -0.717 . . . . 0.0 111.833 179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.438 ' H ' HG12 ' A' ' 111' ' ' ILE . 0.0 OUTLIER -107.89 25.27 2.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.091 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -102.5 9.69 39.37 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.505 -178.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -85.42 98.08 10.37 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.057 -0.52 . . . . 0.0 109.743 177.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.345 -176.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_