data_2aym_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 2aym _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 N--CA 1.459 -0.522 0 N-CA-C 113.587 0.572 . . . . 0.0 113.587 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo . . . . . 0 CA--C 1.533 0.459 0 N-CA-C 115.143 1.17 . . . . 0.0 115.143 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.459 -0.523 0 N-CA-C 114.117 0.776 . . . . 0.0 114.117 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.4 t . . . . . 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.459 -0.525 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo . . . . . 0 CA--C 1.535 0.558 0 N-CA-C 115.048 1.134 . . . . 0.0 115.048 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.935 1.828 . . . . 0.0 115.935 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 114.696 0.999 . . . . 0.0 114.696 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 121.564 0.568 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.476 ' HG3' ' HG1' ' A' ' 71' ' ' THR . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.476 ' HG1' ' HG3' ' A' ' 17' ' ' PRO . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo . . . . . 0 N--CA 1.458 -0.564 0 CA-C-O 120.623 0.176 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.458 -0.569 0 CA-C-O 121.097 0.374 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 N-CA-C 114.323 0.855 . . . . 0.0 114.323 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.46 -0.491 0 N-CA-C 113.656 0.598 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo . . . . . 0 N--CA 1.459 -0.524 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 114.417 0.891 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HG3' ' HG1' ' A' ' 71' ' ' THR . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.406 ' CD1' ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.406 ' H ' ' CD1' ' A' ' 40' ' ' LEU . 22.0 t . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.436 ' HG1' ' HG3' ' A' ' 17' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 114.563 0.947 . . . . 0.0 114.563 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 CA--C 1.536 0.438 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 114.101 0.769 . . . . 0.0 114.101 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo . . . . . 0 N--CA 1.461 -0.435 0 N-CA-C 113.851 0.674 . . . . 0.0 113.851 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 25.7 t . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 114.57 0.95 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo . . . . . 0 N--CA 1.459 -0.534 0 N-CA-C 113.884 0.686 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo . . . . . 0 CA--C 1.534 0.519 0 N-CA-C 115.51 1.311 . . . . 0.0 115.51 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 N--CA 1.459 -0.537 0 N-CA-C 113.576 0.568 . . . . 0.0 113.576 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -64.13 157.02 26.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.859 0.361 . . . . 0.0 110.441 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 16.9 p -139.99 171.88 13.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.875 1.67 . . . . 0.0 107.272 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -134.94 161.31 35.64 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 171.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -152.23 171.54 6.53 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.053 2.141 . . . . 0.0 107.298 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -57.95 161.53 12.92 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 N-CA-C 109.543 -0.983 . . . . 0.0 109.543 150.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -47.14 138.26 16.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.958 2.439 . . . . 0.0 113.587 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 43' ' ' ASN . 48.9 t -112.24 92.01 17.73 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.01 27.07 0.3 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.809 3.673 . . . . 0.0 114.827 -170.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 41' ' ' VAL . 12.0 p30 -133.22 -2.05 3.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.504 2.321 . . . . 0.0 112.152 169.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -134.92 -42.02 0.74 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.53 1.059 . . . . 0.0 112.141 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 59.79 -23.51 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.934 2.894 . . . . 0.0 115.736 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.91 -173.48 3.54 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -133.58 156.06 48.52 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.308 1.043 . . . . 0.0 109.367 -172.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt . . . . . 0 C--O 1.247 0.968 0 C-N-CA 126.489 1.916 . . . . 0.0 107.102 176.554 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -151.75 154.53 36.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.211 1.405 . . . . 0.0 107.913 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -82.16 55.82 2.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.125 1.37 . . . . 0.0 110.453 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -62.61 149.28 43.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -146.0 172.33 5.41 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 126.299 1.84 . . . . 0.0 107.829 -171.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -57.13 158.72 17.07 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 121.419 1.413 . . . . 0.0 110.861 159.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo -48.88 144.18 15.78 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.031 3.154 . . . . 0.0 115.143 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.427 ' C ' ' H ' ' A' ' 43' ' ' ASN . 45.3 t -119.39 86.4 33.53 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.32 28.07 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 125.091 3.86 . . . . 0.0 114.418 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' VAL . 13.2 p30 -129.74 -5.5 4.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.445 2.298 . . . . 0.0 111.753 169.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -129.46 -36.15 1.69 Allowed 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.764 1.166 . . . . 0.0 112.911 170.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 58.22 -24.14 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.134 2.573 . . . . 0.0 116.147 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.55 172.61 11.7 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -126.96 106.92 9.63 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.249 1.055 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 173.141 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -57.63 128.13 35.51 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.367 0.667 . . . . 0.0 110.458 178.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.3 p -72.55 159.36 34.04 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.932 0.893 . . . . 0.0 110.633 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -141.52 154.79 45.71 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 -177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -145.91 170.77 7.38 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 124.803 1.241 . . . . 0.0 109.579 -171.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -59.44 164.34 11.19 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 121.504 1.47 . . . . 0.0 110.164 153.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.12 134.57 18.93 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.478 2.786 . . . . 0.0 114.117 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' A' ' 43' ' ' ASN . 45.4 t -120.27 85.64 36.8 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -73.64 29.88 0.31 Allowed 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.653 3.569 . . . . 0.0 113.924 -171.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.433 ' H ' ' C ' ' A' ' 41' ' ' VAL . 13.4 p30 -129.12 -6.36 4.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.64 2.376 . . . . 0.0 111.328 169.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -128.52 -35.83 1.92 Allowed 'General case' 0 C--N 1.349 0.558 0 CA-C-N 119.722 1.146 . . . . 0.0 112.424 169.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 60.16 -24.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 128.18 2.592 . . . . 0.0 115.8 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.86 -172.59 3.11 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -118.05 176.97 4.96 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.263 1.025 . . . . 0.0 110.356 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--O 1.247 0.957 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 170.927 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.427 -0.32 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -147.75 161.45 41.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.322 1.449 . . . . 0.0 108.844 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.1 p -144.01 166.1 25.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.378 1.471 . . . . 0.0 108.891 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -135.02 146.69 49.25 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -153.48 167.39 13.65 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 126.417 1.887 . . . . 0.0 108.463 -171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -61.28 164.66 14.41 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 122.141 1.894 . . . . 0.0 110.964 161.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -47.96 143.12 14.14 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 124.05 3.167 . . . . 0.0 114.919 -178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.402 ' C ' ' H ' ' A' ' 43' ' ' ASN . 61.3 t -108.39 100.13 36.13 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.53 25.61 0.32 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.385 3.39 . . . . 0.0 115.228 -169.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.402 ' H ' ' C ' ' A' ' 41' ' ' VAL . 10.7 p30 -136.83 -7.19 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.938 2.495 . . . . 0.0 112.543 169.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.4 mmm-85 -144.3 63.63 1.32 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.719 2.408 . . . . 0.0 104.965 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -56.04 -13.71 2.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.493 0.717 . . . . 0.0 112.549 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.93 177.61 6.17 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.82 167.29 17.55 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.211 1.004 . . . . 0.0 109.613 -171.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.1 mtmm . . . . . 0 C--O 1.248 0.978 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -175.236 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -65.87 151.65 46.22 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.924 0.489 . . . . 0.0 110.079 175.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.99 157.4 28.73 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -78.13 142.44 38.05 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 167.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -148.09 169.6 9.0 Favored Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 108.321 -169.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -47.15 144.19 9.33 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 121.838 1.692 . . . . 0.0 110.507 154.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -50.23 146.45 18.12 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.384 2.722 . . . . 0.0 115.048 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.451 ' C ' ' H ' ' A' ' 43' ' ' ASN . 39.1 t -112.82 92.1 19.65 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -72.42 28.13 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.721 3.614 . . . . 0.0 113.968 -175.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.451 ' H ' ' C ' ' A' ' 41' ' ' VAL . 64.4 m-80 -126.48 -8.47 6.3 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.866 2.467 . . . . 0.0 111.161 171.357 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -137.39 -38.78 0.6 Allowed 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.357 0.98 . . . . 0.0 112.607 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 58.53 -24.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.863 2.865 . . . . 0.0 115.935 -172.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.18 153.02 40.87 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -122.89 93.99 4.13 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -169.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt . . . . . 0 C--O 1.248 0.991 0 C-N-CA 125.202 1.401 . . . . 0.0 109.221 -177.464 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -153.01 167.15 30.17 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.183 1.393 . . . . 0.0 108.66 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.44 137.31 19.19 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -85.29 144.84 27.84 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 168.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -148.37 169.97 8.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 125.812 1.645 . . . . 0.0 107.904 -170.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -48.67 148.6 8.26 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.038 1.825 . . . . 0.0 111.128 158.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -50.5 146.39 19.62 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.466 2.777 . . . . 0.0 114.696 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.425 ' C ' ' H ' ' A' ' 43' ' ' ASN . 46.6 t -122.3 84.66 46.83 Favored Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.76 27.35 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.475 3.45 . . . . 0.0 114.354 -169.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.425 ' H ' ' C ' ' A' ' 41' ' ' VAL . 13.4 p30 -125.79 -6.07 6.84 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.516 2.327 . . . . 0.0 111.309 169.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -128.3 -38.43 1.77 Allowed 'General case' 0 C--N 1.347 0.469 0 CA-C-N 119.44 1.018 . . . . 0.0 112.438 169.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 60.57 -23.39 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.008 2.523 . . . . 0.0 115.606 -178.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.87 161.65 30.46 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.85 116.3 26.23 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm . . . . . 0 C--O 1.249 1.067 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.815 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -68.07 151.29 47.27 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.61 148.99 21.69 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 175.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.81 145.15 34.47 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 168.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -148.47 172.34 5.29 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 125.124 1.369 . . . . 0.0 108.681 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -45.14 145.98 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 121.968 1.779 . . . . 0.0 110.47 152.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.76 153.6 77.38 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.008 1.805 . . . . 0.0 112.862 -169.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.476 ' HG3' ' HG1' ' A' ' 71' ' ' THR . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.425 ' C ' ' H ' ' A' ' 43' ' ' ASN . 47.4 t -109.8 102.01 48.82 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.46 26.52 0.27 Allowed 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 124.564 3.509 . . . . 0.0 114.562 -173.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.425 ' H ' ' C ' ' A' ' 41' ' ' VAL . 61.8 m-80 -129.96 -15.16 3.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.169 2.587 . . . . 0.0 111.823 170.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -149.0 75.68 1.31 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 127.52 2.328 . . . . 0.0 105.023 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -58.89 -12.43 4.46 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.58 -0.7 . . . . 0.0 112.04 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.476 ' HG1' ' HG3' ' A' ' 17' ' ' PRO . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.51 152.09 44.37 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -120.73 91.14 3.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -169.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.259 1.024 . . . . 0.0 109.513 -175.829 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -57.63 124.74 20.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.398 0.679 . . . . 0.0 110.084 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.2 p -76.07 169.91 17.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.404 1.082 . . . . 0.0 110.001 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.43 148.43 49.3 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -141.9 170.66 8.65 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.13 1.772 . . . . 0.0 107.857 -169.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -50.44 161.91 1.07 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.084 1.856 . . . . 0.0 111.214 154.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.46 133.39 16.21 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.127 2.551 . . . . 0.0 112.494 175.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t -108.03 102.2 44.83 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.92 23.99 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.636 3.557 . . . . 0.0 115.392 -169.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -135.32 -8.19 2.25 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.678 2.391 . . . . 0.0 112.602 169.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -146.75 72.03 1.26 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.297 2.239 . . . . 0.0 105.128 171.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -58.27 -12.83 4.05 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.52 -0.737 . . . . 0.0 112.007 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.2 -163.18 0.13 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -129.24 -177.2 4.14 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.952 1.301 . . . . 0.0 109.052 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm . . . . . 0 C--O 1.246 0.901 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 175.703 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -67.08 149.64 50.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.82 0.448 . . . . 0.0 109.888 175.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -159.72 158.23 30.93 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -78.56 147.09 33.89 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -146.92 169.95 8.58 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.963 1.305 . . . . 0.0 108.016 -170.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.99 157.6 0.53 Allowed 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 122.311 2.008 . . . . 0.0 111.163 151.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.38 143.62 93.58 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.397 2.064 . . . . 0.0 112.024 -173.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' A' ' 43' ' ' ASN . 40.4 t -120.06 86.45 37.19 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.67 27.42 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.694 3.596 . . . . 0.0 114.648 -170.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.413 ' H ' ' C ' ' A' ' 41' ' ' VAL . 12.1 p30 -130.02 -2.22 4.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.791 2.436 . . . . 0.0 111.411 169.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -125.99 -45.39 1.72 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 124.621 1.169 . . . . 0.0 110.344 173.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 63.14 -28.89 0.08 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.633 2.773 . . . . 0.0 115.01 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.74 177.32 5.55 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -129.74 86.24 2.39 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -171.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt . . . . . 0 C--O 1.247 0.968 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 169.886 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -67.01 149.34 50.76 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.923 0.489 . . . . 0.0 109.725 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 m -159.63 155.87 26.93 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -77.49 143.52 38.42 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 167.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -146.68 167.51 13.63 Favored Pre-proline 0 C--O 1.237 0.409 0 C-N-CA 124.638 1.175 . . . . 0.0 108.262 -170.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -47.6 145.7 8.81 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 121.715 1.61 . . . . 0.0 110.149 153.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.48 143.6 20.57 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.152 2.568 . . . . 0.0 114.323 -174.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.427 ' C ' ' H ' ' A' ' 43' ' ' ASN . 59.1 t -115.6 88.2 19.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -74.14 29.64 0.33 Allowed 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 124.525 3.484 . . . . 0.0 113.714 -171.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 41' ' ' VAL . 16.4 p30 -123.93 -11.08 7.67 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.493 2.317 . . . . 0.0 111.031 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -128.76 -30.36 2.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 119.8 1.182 . . . . 0.0 113.237 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 57.21 -16.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 127.635 2.374 . . . . 0.0 115.629 -176.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.34 171.49 14.47 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -125.73 167.68 14.82 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.967 0.907 . . . . 0.0 108.771 -174.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.25 1.115 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 -179.186 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -143.8 160.9 39.93 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 108.148 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -143.01 172.01 13.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.763 1.625 . . . . 0.0 107.715 171.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -136.28 167.22 21.72 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.021 1.329 . . . . 0.0 108.812 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -151.07 174.4 3.58 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 127.319 2.248 . . . . 0.0 107.652 -173.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -57.8 165.3 6.64 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 121.14 1.226 . . . . 0.0 110.004 148.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -45.95 136.34 13.71 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.191 2.594 . . . . 0.0 113.656 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.45 ' C ' ' H ' ' A' ' 43' ' ' ASN . 45.8 t -115.94 90.75 28.77 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.69 27.46 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.951 3.1 . . . . 0.0 113.67 -174.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 41' ' ' VAL . 68.4 m-80 -121.0 -11.41 8.91 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.941 2.496 . . . . 0.0 110.77 171.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -132.32 -34.01 1.25 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.368 0.986 . . . . 0.0 112.816 173.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 60.49 -23.14 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.22 2.608 . . . . 0.0 115.547 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.56 -178.3 3.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -134.96 96.36 3.5 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -171.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt . . . . . 0 C--O 1.251 1.141 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 172.789 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.23 145.34 56.15 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 p -145.74 154.11 41.7 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.325 1.45 . . . . 0.0 107.54 170.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -104.9 133.33 49.89 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 169.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -149.65 165.46 17.55 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 126.31 1.844 . . . . 0.0 107.651 -170.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.21 155.27 6.75 Favored 'Trans proline' 0 CA--C 1.545 1.075 0 C-N-CA 122.21 1.94 . . . . 0.0 111.351 159.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.12 140.15 19.88 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.512 2.808 . . . . 0.0 113.203 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.64 101.78 44.82 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -72.96 24.67 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.898 3.732 . . . . 0.0 115.26 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.79 -8.79 2.12 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.614 2.366 . . . . 0.0 112.621 169.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.0 mtp180 -146.46 72.99 1.3 Allowed 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.129 -2.175 . . . . 0.0 105.129 171.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -57.95 -12.27 3.11 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.514 -0.741 . . . . 0.0 112.248 178.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.75 -169.71 1.6 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -142.58 166.62 24.15 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.816 1.246 . . . . 0.0 108.528 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt . . . . . 0 C--O 1.25 1.112 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.821 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 119.508 -0.282 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -151.63 142.98 23.42 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.898 1.279 . . . . 0.0 108.397 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.0 p -76.1 158.71 31.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.931 0.893 . . . . 0.0 110.634 -176.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -141.97 129.7 21.62 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -150.63 168.86 10.19 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.484 1.514 . . . . 0.0 108.784 -169.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -50.66 160.86 1.53 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.537 2.158 . . . . 0.0 111.728 154.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -48.37 141.34 19.23 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.574 2.849 . . . . 0.0 114.417 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.436 ' HG3' ' HG1' ' A' ' 71' ' ' THR . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.406 ' CD1' ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.422 ' C ' ' H ' ' A' ' 43' ' ' ASN . 22.0 t -118.48 85.8 27.0 Favored Pre-proline 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.92 26.5 0.25 Allowed 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 125.174 3.916 . . . . 0.0 114.941 -173.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 41' ' ' VAL . 10.3 p30 -133.71 2.61 3.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.679 2.392 . . . . 0.0 111.493 169.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.6 mmm-85 -132.02 -46.21 0.94 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.342 1.057 . . . . 0.0 110.688 176.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 61.18 -28.09 0.05 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.937 2.895 . . . . 0.0 115.462 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.436 ' HG1' ' HG3' ' A' ' 17' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.43 -176.63 5.79 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -130.6 126.45 36.71 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.212 1.005 . . . . 0.0 108.309 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 170.747 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -58.16 125.4 23.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.469 0.708 . . . . 0.0 109.884 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 p -72.54 161.39 30.86 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.857 1.263 . . . . 0.0 110.608 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.46 159.76 34.41 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.545 1.138 . . . . 0.0 108.301 178.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 -152.41 166.19 15.87 Favored Pre-proline 0 CA--C 1.538 0.496 0 C-N-CA 126.588 1.955 . . . . 0.0 108.176 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -50.7 158.83 2.61 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.697 2.265 . . . . 0.0 111.626 156.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -49.95 144.02 22.59 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.202 2.601 . . . . 0.0 114.563 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.423 ' C ' ' H ' ' A' ' 43' ' ' ASN . 40.8 t -119.57 84.42 30.02 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -73.79 28.84 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.622 3.548 . . . . 0.0 114.163 -170.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 41' ' ' VAL . 12.7 p30 -129.56 -3.46 4.8 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.92 2.488 . . . . 0.0 111.41 169.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -131.54 -38.96 1.15 Allowed 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.301 0.955 . . . . 0.0 112.186 172.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 60.2 -24.42 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.399 2.679 . . . . 0.0 115.642 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.06 169.87 15.45 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.2 mptt -129.62 53.64 1.89 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -173.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt . . . . . 0 C--O 1.249 1.049 0 C-N-CA 126.154 1.782 . . . . 0.0 109.133 -174.194 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -60.1 143.96 50.87 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -145.24 147.78 32.78 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.912 0.885 . . . . 0.0 109.749 175.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -112.13 53.03 0.74 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.986 1.314 . . . . 0.0 107.645 -176.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.54 163.63 8.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.51 1.124 . . . . 0.0 110.637 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -48.86 153.55 3.69 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 121.96 1.773 . . . . 0.0 110.615 152.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.66 139.81 23.37 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.029 2.486 . . . . 0.0 114.101 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.429 ' C ' ' H ' ' A' ' 43' ' ' ASN . 40.4 t -122.61 84.99 48.7 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.71 28.94 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.487 3.458 . . . . 0.0 114.05 -171.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.429 ' H ' ' C ' ' A' ' 41' ' ' VAL . 13.9 p30 -126.93 -6.54 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.753 2.421 . . . . 0.0 111.337 169.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . 0.445 ' C ' ' H ' ' A' ' 46' ' ' ASP . 37.4 mtp180 -129.06 -39.47 1.56 Allowed 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.531 1.06 . . . . 0.0 111.957 169.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 60.9 -24.26 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.988 2.515 . . . . 0.0 114.807 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.445 ' H ' ' C ' ' A' ' 44' ' ' ARG . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.97 -176.85 5.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -128.95 169.19 14.96 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.991 0.917 . . . . 0.0 109.813 -170.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt . . . . . 0 C--O 1.25 1.115 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 -178.223 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -146.25 147.85 31.86 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 170.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -81.79 56.73 3.15 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.769 1.628 . . . . 0.0 110.594 -174.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.22 152.94 39.48 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.532 0.733 . . . . 0.0 110.17 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -147.92 171.72 6.01 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 126.048 1.739 . . . . 0.0 107.885 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.4 156.68 3.83 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 122.174 1.916 . . . . 0.0 111.769 157.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.1 141.18 23.44 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.588 2.859 . . . . 0.0 113.851 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.457 ' C ' ' H ' ' A' ' 43' ' ' ASN . 25.7 t -118.61 84.54 24.69 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.35 29.67 0.3 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 124.458 3.439 . . . . 0.0 113.411 -174.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' A' ' 41' ' ' VAL . 59.5 m-80 -125.52 -7.95 6.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 128.11 2.564 . . . . 0.0 110.762 170.331 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -139.92 -36.69 0.49 Allowed 'General case' 0 C--N 1.348 0.535 0 CA-C-N 119.687 1.13 . . . . 0.0 111.841 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 63.45 -25.88 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.775 2.43 . . . . 0.0 115.802 176.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.73 178.44 4.8 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -122.86 172.9 8.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.868 1.267 . . . . 0.0 109.554 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 C--O 1.249 1.072 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -177.09 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -58.23 127.37 31.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.427 0.691 . . . . 0.0 110.253 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -77.68 171.01 15.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.491 1.517 . . . . 0.0 110.712 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -129.57 167.33 18.08 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.292 1.437 . . . . 0.0 107.598 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -148.87 168.76 10.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.235 1.814 . . . . 0.0 108.195 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -50.22 162.06 0.93 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.303 2.002 . . . . 0.0 111.3 153.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.94 143.26 13.82 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.178 2.586 . . . . 0.0 114.57 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.401 ' C ' ' H ' ' A' ' 43' ' ' ASN . 68.0 t -109.34 100.62 42.11 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.21 24.62 0.26 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.909 3.74 . . . . 0.0 115.545 -170.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 41' ' ' VAL . 11.5 p30 -135.31 -8.65 2.25 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.662 2.385 . . . . 0.0 112.554 169.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.7 mtp180 -147.13 73.08 1.29 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.31 2.244 . . . . 0.0 105.274 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -57.31 -13.11 2.92 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.451 -0.781 . . . . 0.0 112.273 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.12 162.48 24.74 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -123.65 27.68 7.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.471 0.709 . . . . 0.0 112.248 -174.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.586 2.354 . . . . 0.0 110.488 177.133 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -139.19 57.46 1.66 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.519 0.676 . . . . 0.0 109.471 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.1 m -46.35 132.39 10.24 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 110.03 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -87.7 155.98 19.67 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.577 0.751 . . . . 0.0 109.571 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -136.01 169.85 12.5 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.683 1.993 . . . . 0.0 107.753 -176.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -58.23 163.44 10.1 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.248 1.299 . . . . 0.0 110.026 155.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -46.4 136.19 15.44 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.372 2.715 . . . . 0.0 113.884 -177.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.431 ' C ' ' H ' ' A' ' 43' ' ' ASN . 39.1 t -120.99 84.12 38.7 Favored Pre-proline 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.81 28.83 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.642 3.562 . . . . 0.0 114.032 -171.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 41' ' ' VAL . 12.4 p30 -130.5 -2.65 4.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.916 2.486 . . . . 0.0 111.464 169.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -132.22 -40.31 1.02 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.375 0.989 . . . . 0.0 112.006 171.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 61.84 -26.48 0.05 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.416 2.686 . . . . 0.0 115.3 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.61 -174.97 1.87 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -123.37 176.06 6.36 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 110.331 -176.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 C--O 1.25 1.123 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 173.834 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.12 171.48 5.59 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.067 0.46 . . . . 0.0 111.032 176.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -132.98 67.58 1.53 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.935 1.294 . . . . 0.0 108.358 -172.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.32 153.49 26.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -147.88 171.98 5.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 125.877 1.671 . . . . 0.0 108.426 -170.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.22 151.0 4.68 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 122.166 1.911 . . . . 0.0 111.656 157.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -49.66 146.0 16.24 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.83 3.02 . . . . 0.0 115.51 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.412 ' C ' ' H ' ' A' ' 43' ' ' ASN . 45.8 t -108.3 91.15 7.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.39 26.2 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.798 3.665 . . . . 0.0 114.78 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 41' ' ' VAL . 11.9 p30 -131.29 -1.43 3.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.398 2.279 . . . . 0.0 111.992 169.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -133.84 -41.97 0.83 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.297 0.953 . . . . 0.0 112.086 173.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 58.83 -23.9 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.886 2.874 . . . . 0.0 115.754 -173.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.09 153.23 42.73 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.06 106.12 12.56 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--O 1.249 1.043 0 C-N-CA 124.107 0.963 . . . . 0.0 108.907 -179.043 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.075 0 CA-C-O 119.526 -0.274 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -151.51 160.62 43.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.204 1.401 . . . . 0.0 108.587 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 m -145.46 143.13 29.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -74.53 140.78 44.72 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -148.07 164.65 21.19 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 125.198 1.399 . . . . 0.0 108.379 -174.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.09 158.45 5.03 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.666 2.244 . . . . 0.0 111.867 161.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.29 140.08 20.87 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.556 2.837 . . . . 0.0 113.576 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.42 ' C ' ' H ' ' A' ' 43' ' ' ASN . 41.2 t -118.08 85.98 25.14 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.02 28.44 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 124.569 3.513 . . . . 0.0 114.333 -170.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.42 ' H ' ' C ' ' A' ' 41' ' ' VAL . 12.4 p30 -130.27 -2.52 4.45 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.817 2.447 . . . . 0.0 111.486 169.554 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -132.65 -40.36 0.97 Allowed 'General case' 0 C--N 1.346 0.422 0 CA-C-N 119.239 0.927 . . . . 0.0 111.93 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 60.72 -24.47 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.659 2.784 . . . . 0.0 115.273 -177.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.97 178.17 6.47 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -128.68 116.64 19.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 -177.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 172.536 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 N--CA 1.459 -0.522 0 N-CA-C 113.587 0.572 . . . . 0.0 113.587 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo . . . . . 0 CA--C 1.533 0.459 0 N-CA-C 115.143 1.17 . . . . 0.0 115.143 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.459 -0.523 0 N-CA-C 114.117 0.776 . . . . 0.0 114.117 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' C ' HD12 ' A' ' 13' ' ' LEU . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' H ' HD13 ' A' ' 40' ' ' LEU . 45.4 t . . . . . 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.459 -0.525 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo . . . . . 0 CA--C 1.535 0.558 0 N-CA-C 115.048 1.134 . . . . 0.0 115.048 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.935 1.828 . . . . 0.0 115.935 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.474 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 114.696 0.999 . . . . 0.0 114.696 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 121.564 0.568 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' C ' HD12 ' A' ' 13' ' ' LEU . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.42 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo . . . . . 0 N--CA 1.458 -0.564 0 CA-C-O 120.623 0.176 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.458 -0.569 0 CA-C-O 121.097 0.374 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.439 HG22 HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 14' ' ' THR . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 N-CA-C 114.323 0.855 . . . . 0.0 114.323 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.46 -0.491 0 N-CA-C 113.656 0.598 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.401 ' C ' HD12 ' A' ' 13' ' ' LEU . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo . . . . . 0 N--CA 1.459 -0.524 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 114.417 0.891 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 72' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 71' ' ' THR . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 114.563 0.947 . . . . 0.0 114.563 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.421 HG22 HG22 ' A' ' 47' ' ' ILE . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 CA--C 1.536 0.438 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 114.101 0.769 . . . . 0.0 114.101 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo . . . . . 0 N--CA 1.461 -0.435 0 N-CA-C 113.851 0.674 . . . . 0.0 113.851 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.409 ' H ' HD13 ' A' ' 40' ' ' LEU . 25.7 t . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 114.57 0.95 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo . . . . . 0 N--CA 1.459 -0.534 0 N-CA-C 113.884 0.686 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo . . . . . 0 CA--C 1.534 0.519 0 N-CA-C 115.51 1.311 . . . . 0.0 115.51 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HB3' HD21 ' A' ' 16' ' ' LEU . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 ' HB3' ' A' ' 13' ' ' LEU . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 N--CA 1.459 -0.537 0 N-CA-C 113.576 0.568 . . . . 0.0 113.576 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.427 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -64.13 157.02 26.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.859 0.361 . . . . 0.0 110.441 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 16.9 p -139.99 171.88 13.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.875 1.67 . . . . 0.0 107.272 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -134.94 161.31 35.64 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 171.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -152.23 171.54 6.53 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.053 2.141 . . . . 0.0 107.298 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -57.95 161.53 12.92 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 N-CA-C 109.543 -0.983 . . . . 0.0 109.543 150.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -47.14 138.26 16.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.958 2.439 . . . . 0.0 113.587 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t -112.24 92.01 17.73 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.01 27.07 0.3 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.809 3.673 . . . . 0.0 114.827 -170.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -133.22 -2.05 3.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.504 2.321 . . . . 0.0 112.152 169.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -134.92 -42.02 0.74 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.53 1.059 . . . . 0.0 112.141 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 59.79 -23.51 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.934 2.894 . . . . 0.0 115.736 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.91 -173.48 3.54 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -133.58 156.06 48.52 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.308 1.043 . . . . 0.0 109.367 -172.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt . . . . . 0 C--O 1.247 0.968 0 C-N-CA 126.489 1.916 . . . . 0.0 107.102 176.554 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -151.75 154.53 36.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.211 1.405 . . . . 0.0 107.913 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -82.16 55.82 2.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.125 1.37 . . . . 0.0 110.453 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -62.61 149.28 43.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -146.0 172.33 5.41 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 126.299 1.84 . . . . 0.0 107.829 -171.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -57.13 158.72 17.07 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 121.419 1.413 . . . . 0.0 110.861 159.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo -48.88 144.18 15.78 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.031 3.154 . . . . 0.0 115.143 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.3 t -119.39 86.4 33.53 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.32 28.07 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 125.091 3.86 . . . . 0.0 114.418 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -129.74 -5.5 4.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.445 2.298 . . . . 0.0 111.753 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -129.46 -36.15 1.69 Allowed 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.764 1.166 . . . . 0.0 112.911 170.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 58.22 -24.14 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.134 2.573 . . . . 0.0 116.147 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.55 172.61 11.7 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -126.96 106.92 9.63 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.249 1.055 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 173.141 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -57.63 128.13 35.51 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.367 0.667 . . . . 0.0 110.458 178.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.3 p -72.55 159.36 34.04 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.932 0.893 . . . . 0.0 110.633 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -141.52 154.79 45.71 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 -177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -145.91 170.77 7.38 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 124.803 1.241 . . . . 0.0 109.579 -171.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -59.44 164.34 11.19 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 121.504 1.47 . . . . 0.0 110.164 153.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.12 134.57 18.93 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.478 2.786 . . . . 0.0 114.117 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' C ' HD12 ' A' ' 13' ' ' LEU . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' H ' HD13 ' A' ' 40' ' ' LEU . 45.4 t -120.27 85.64 36.8 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -73.64 29.88 0.31 Allowed 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.653 3.569 . . . . 0.0 113.924 -171.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -129.12 -6.36 4.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.64 2.376 . . . . 0.0 111.328 169.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -128.52 -35.83 1.92 Allowed 'General case' 0 C--N 1.349 0.558 0 CA-C-N 119.722 1.146 . . . . 0.0 112.424 169.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 60.16 -24.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 128.18 2.592 . . . . 0.0 115.8 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.86 -172.59 3.11 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -118.05 176.97 4.96 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.263 1.025 . . . . 0.0 110.356 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--O 1.247 0.957 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 170.927 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.427 -0.32 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -147.75 161.45 41.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.322 1.449 . . . . 0.0 108.844 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.1 p -144.01 166.1 25.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.378 1.471 . . . . 0.0 108.891 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -135.02 146.69 49.25 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -153.48 167.39 13.65 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 126.417 1.887 . . . . 0.0 108.463 -171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -61.28 164.66 14.41 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 122.141 1.894 . . . . 0.0 110.964 161.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -47.96 143.12 14.14 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 124.05 3.167 . . . . 0.0 114.919 -178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.3 t -108.39 100.13 36.13 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.53 25.61 0.32 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.385 3.39 . . . . 0.0 115.228 -169.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -136.83 -7.19 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.938 2.495 . . . . 0.0 112.543 169.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.4 mmm-85 -144.3 63.63 1.32 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.719 2.408 . . . . 0.0 104.965 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -56.04 -13.71 2.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.493 0.717 . . . . 0.0 112.549 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.93 177.61 6.17 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.82 167.29 17.55 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.211 1.004 . . . . 0.0 109.613 -171.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.1 mtmm . . . . . 0 C--O 1.248 0.978 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -175.236 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -65.87 151.65 46.22 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.924 0.489 . . . . 0.0 110.079 175.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.99 157.4 28.73 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -78.13 142.44 38.05 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 167.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -148.09 169.6 9.0 Favored Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 108.321 -169.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -47.15 144.19 9.33 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 121.838 1.692 . . . . 0.0 110.507 154.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -50.23 146.45 18.12 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.384 2.722 . . . . 0.0 115.048 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t -112.82 92.1 19.65 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -72.42 28.13 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.721 3.614 . . . . 0.0 113.968 -175.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -126.48 -8.47 6.3 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.866 2.467 . . . . 0.0 111.161 171.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -137.39 -38.78 0.6 Allowed 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.357 0.98 . . . . 0.0 112.607 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 58.53 -24.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.863 2.865 . . . . 0.0 115.935 -172.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.474 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.18 153.02 40.87 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -122.89 93.99 4.13 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -169.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt . . . . . 0 C--O 1.248 0.991 0 C-N-CA 125.202 1.401 . . . . 0.0 109.221 -177.464 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -153.01 167.15 30.17 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.183 1.393 . . . . 0.0 108.66 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.44 137.31 19.19 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -85.29 144.84 27.84 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 168.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -148.37 169.97 8.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 125.812 1.645 . . . . 0.0 107.904 -170.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -48.67 148.6 8.26 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.038 1.825 . . . . 0.0 111.128 158.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -50.5 146.39 19.62 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.466 2.777 . . . . 0.0 114.696 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -122.3 84.66 46.83 Favored Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.76 27.35 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.475 3.45 . . . . 0.0 114.354 -169.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -125.79 -6.07 6.84 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.516 2.327 . . . . 0.0 111.309 169.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -128.3 -38.43 1.77 Allowed 'General case' 0 C--N 1.347 0.469 0 CA-C-N 119.44 1.018 . . . . 0.0 112.438 169.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 60.57 -23.39 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.008 2.523 . . . . 0.0 115.606 -178.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.87 161.65 30.46 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.85 116.3 26.23 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm . . . . . 0 C--O 1.249 1.067 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.815 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -68.07 151.29 47.27 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.61 148.99 21.69 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 175.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.81 145.15 34.47 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 168.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -148.47 172.34 5.29 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 125.124 1.369 . . . . 0.0 108.681 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -45.14 145.98 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 121.968 1.779 . . . . 0.0 110.47 152.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.76 153.6 77.38 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.008 1.805 . . . . 0.0 112.862 -169.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' C ' HD12 ' A' ' 13' ' ' LEU . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.42 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.4 t -109.8 102.01 48.82 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.46 26.52 0.27 Allowed 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 124.564 3.509 . . . . 0.0 114.562 -173.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -129.96 -15.16 3.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.169 2.587 . . . . 0.0 111.823 170.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -149.0 75.68 1.31 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 127.52 2.328 . . . . 0.0 105.023 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -58.89 -12.43 4.46 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.58 -0.7 . . . . 0.0 112.04 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.51 152.09 44.37 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -120.73 91.14 3.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -169.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.259 1.024 . . . . 0.0 109.513 -175.829 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -57.63 124.74 20.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.398 0.679 . . . . 0.0 110.084 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.2 p -76.07 169.91 17.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.404 1.082 . . . . 0.0 110.001 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.43 148.43 49.3 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -141.9 170.66 8.65 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.13 1.772 . . . . 0.0 107.857 -169.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -50.44 161.91 1.07 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.084 1.856 . . . . 0.0 111.214 154.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.46 133.39 16.21 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.127 2.551 . . . . 0.0 112.494 175.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t -108.03 102.2 44.83 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.92 23.99 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.636 3.557 . . . . 0.0 115.392 -169.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -135.32 -8.19 2.25 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.678 2.391 . . . . 0.0 112.602 169.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -146.75 72.03 1.26 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.297 2.239 . . . . 0.0 105.128 171.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -58.27 -12.83 4.05 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.52 -0.737 . . . . 0.0 112.007 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.2 -163.18 0.13 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -129.24 -177.2 4.14 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.952 1.301 . . . . 0.0 109.052 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm . . . . . 0 C--O 1.246 0.901 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 175.703 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -67.08 149.64 50.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.82 0.448 . . . . 0.0 109.888 175.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -159.72 158.23 30.93 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -78.56 147.09 33.89 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -146.92 169.95 8.58 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.963 1.305 . . . . 0.0 108.016 -170.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.99 157.6 0.53 Allowed 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 122.311 2.008 . . . . 0.0 111.163 151.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.38 143.62 93.58 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.397 2.064 . . . . 0.0 112.024 -173.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.439 HG22 HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.06 86.45 37.19 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.67 27.42 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.694 3.596 . . . . 0.0 114.648 -170.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -130.02 -2.22 4.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.791 2.436 . . . . 0.0 111.411 169.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -125.99 -45.39 1.72 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 124.621 1.169 . . . . 0.0 110.344 173.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 63.14 -28.89 0.08 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.633 2.773 . . . . 0.0 115.01 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 14' ' ' THR . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.74 177.32 5.55 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -129.74 86.24 2.39 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -171.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt . . . . . 0 C--O 1.247 0.968 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 169.886 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -67.01 149.34 50.76 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.923 0.489 . . . . 0.0 109.725 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 m -159.63 155.87 26.93 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -77.49 143.52 38.42 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 167.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -146.68 167.51 13.63 Favored Pre-proline 0 C--O 1.237 0.409 0 C-N-CA 124.638 1.175 . . . . 0.0 108.262 -170.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -47.6 145.7 8.81 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 121.715 1.61 . . . . 0.0 110.149 153.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.48 143.6 20.57 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.152 2.568 . . . . 0.0 114.323 -174.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.6 88.2 19.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -74.14 29.64 0.33 Allowed 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 124.525 3.484 . . . . 0.0 113.714 -171.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -123.93 -11.08 7.67 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.493 2.317 . . . . 0.0 111.031 169.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -128.76 -30.36 2.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 119.8 1.182 . . . . 0.0 113.237 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 57.21 -16.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 127.635 2.374 . . . . 0.0 115.629 -176.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.34 171.49 14.47 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -125.73 167.68 14.82 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.967 0.907 . . . . 0.0 108.771 -174.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.25 1.115 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 -179.186 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -143.8 160.9 39.93 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 108.148 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -143.01 172.01 13.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.763 1.625 . . . . 0.0 107.715 171.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -136.28 167.22 21.72 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.021 1.329 . . . . 0.0 108.812 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -151.07 174.4 3.58 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 127.319 2.248 . . . . 0.0 107.652 -173.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -57.8 165.3 6.64 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 121.14 1.226 . . . . 0.0 110.004 148.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -45.95 136.34 13.71 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.191 2.594 . . . . 0.0 113.656 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.401 ' C ' HD12 ' A' ' 13' ' ' LEU . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t -115.94 90.75 28.77 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.69 27.46 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.951 3.1 . . . . 0.0 113.67 -174.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -121.0 -11.41 8.91 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.941 2.496 . . . . 0.0 110.77 171.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -132.32 -34.01 1.25 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.368 0.986 . . . . 0.0 112.816 173.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 60.49 -23.14 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.22 2.608 . . . . 0.0 115.547 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.56 -178.3 3.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -134.96 96.36 3.5 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -171.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt . . . . . 0 C--O 1.251 1.141 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 172.789 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.23 145.34 56.15 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 p -145.74 154.11 41.7 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.325 1.45 . . . . 0.0 107.54 170.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -104.9 133.33 49.89 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 169.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -149.65 165.46 17.55 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 126.31 1.844 . . . . 0.0 107.651 -170.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.21 155.27 6.75 Favored 'Trans proline' 0 CA--C 1.545 1.075 0 C-N-CA 122.21 1.94 . . . . 0.0 111.351 159.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.12 140.15 19.88 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.512 2.808 . . . . 0.0 113.203 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.64 101.78 44.82 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -72.96 24.67 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.898 3.732 . . . . 0.0 115.26 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.79 -8.79 2.12 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.614 2.366 . . . . 0.0 112.621 169.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.0 mtp180 -146.46 72.99 1.3 Allowed 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.129 -2.175 . . . . 0.0 105.129 171.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -57.95 -12.27 3.11 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.514 -0.741 . . . . 0.0 112.248 178.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.75 -169.71 1.6 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -142.58 166.62 24.15 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.816 1.246 . . . . 0.0 108.528 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt . . . . . 0 C--O 1.25 1.112 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.821 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 119.508 -0.282 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -151.63 142.98 23.42 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.898 1.279 . . . . 0.0 108.397 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.0 p -76.1 158.71 31.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.931 0.893 . . . . 0.0 110.634 -176.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -141.97 129.7 21.62 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -150.63 168.86 10.19 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.484 1.514 . . . . 0.0 108.784 -169.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -50.66 160.86 1.53 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.537 2.158 . . . . 0.0 111.728 154.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -48.37 141.34 19.23 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.574 2.849 . . . . 0.0 114.417 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 t -118.48 85.8 27.0 Favored Pre-proline 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.92 26.5 0.25 Allowed 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 125.174 3.916 . . . . 0.0 114.941 -173.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -133.71 2.61 3.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.679 2.392 . . . . 0.0 111.493 169.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.6 mmm-85 -132.02 -46.21 0.94 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.342 1.057 . . . . 0.0 110.688 176.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 61.18 -28.09 0.05 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.937 2.895 . . . . 0.0 115.462 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 72' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 71' ' ' THR . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.43 -176.63 5.79 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -130.6 126.45 36.71 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.212 1.005 . . . . 0.0 108.309 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 170.747 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -58.16 125.4 23.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.469 0.708 . . . . 0.0 109.884 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 p -72.54 161.39 30.86 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.857 1.263 . . . . 0.0 110.608 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.46 159.76 34.41 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.545 1.138 . . . . 0.0 108.301 178.464 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 -152.41 166.19 15.87 Favored Pre-proline 0 CA--C 1.538 0.496 0 C-N-CA 126.588 1.955 . . . . 0.0 108.176 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -50.7 158.83 2.61 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.697 2.265 . . . . 0.0 111.626 156.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -49.95 144.02 22.59 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.202 2.601 . . . . 0.0 114.563 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.421 HG22 HG22 ' A' ' 47' ' ' ILE . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t -119.57 84.42 30.02 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -73.79 28.84 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.622 3.548 . . . . 0.0 114.163 -170.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -129.56 -3.46 4.8 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.92 2.488 . . . . 0.0 111.41 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -131.54 -38.96 1.15 Allowed 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.301 0.955 . . . . 0.0 112.186 172.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 60.2 -24.42 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.399 2.679 . . . . 0.0 115.642 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.06 169.87 15.45 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.2 mptt -129.62 53.64 1.89 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -173.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt . . . . . 0 C--O 1.249 1.049 0 C-N-CA 126.154 1.782 . . . . 0.0 109.133 -174.194 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -60.1 143.96 50.87 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -145.24 147.78 32.78 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.912 0.885 . . . . 0.0 109.749 175.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -112.13 53.03 0.74 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.986 1.314 . . . . 0.0 107.645 -176.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.54 163.63 8.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.51 1.124 . . . . 0.0 110.637 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -48.86 153.55 3.69 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 121.96 1.773 . . . . 0.0 110.615 152.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.66 139.81 23.37 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.029 2.486 . . . . 0.0 114.101 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.61 84.99 48.7 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.71 28.94 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.487 3.458 . . . . 0.0 114.05 -171.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -126.93 -6.54 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.753 2.421 . . . . 0.0 111.337 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . 0.411 ' C ' ' H ' ' A' ' 46' ' ' ASP . 37.4 mtp180 -129.06 -39.47 1.56 Allowed 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.531 1.06 . . . . 0.0 111.957 169.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 60.9 -24.26 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.988 2.515 . . . . 0.0 114.807 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 44' ' ' ARG . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.97 -176.85 5.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -128.95 169.19 14.96 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.991 0.917 . . . . 0.0 109.813 -170.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt . . . . . 0 C--O 1.25 1.115 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 -178.223 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -146.25 147.85 31.86 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 170.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -81.79 56.73 3.15 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.769 1.628 . . . . 0.0 110.594 -174.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.22 152.94 39.48 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.532 0.733 . . . . 0.0 110.17 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -147.92 171.72 6.01 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 126.048 1.739 . . . . 0.0 107.885 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.4 156.68 3.83 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 122.174 1.916 . . . . 0.0 111.769 157.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.1 141.18 23.44 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.588 2.859 . . . . 0.0 113.851 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.412 ' C ' ' H ' ' A' ' 43' ' ' ASN . 25.7 t -118.61 84.54 24.69 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.35 29.67 0.3 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 124.458 3.439 . . . . 0.0 113.411 -174.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 41' ' ' VAL . 59.5 m-80 -125.52 -7.95 6.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 128.11 2.564 . . . . 0.0 110.762 170.331 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -139.92 -36.69 0.49 Allowed 'General case' 0 C--N 1.348 0.535 0 CA-C-N 119.687 1.13 . . . . 0.0 111.841 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 63.45 -25.88 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.775 2.43 . . . . 0.0 115.802 176.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.73 178.44 4.8 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -122.86 172.9 8.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.868 1.267 . . . . 0.0 109.554 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 C--O 1.249 1.072 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -177.09 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -58.23 127.37 31.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.427 0.691 . . . . 0.0 110.253 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -77.68 171.01 15.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.491 1.517 . . . . 0.0 110.712 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -129.57 167.33 18.08 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.292 1.437 . . . . 0.0 107.598 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -148.87 168.76 10.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.235 1.814 . . . . 0.0 108.195 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -50.22 162.06 0.93 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.303 2.002 . . . . 0.0 111.3 153.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.94 143.26 13.82 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.178 2.586 . . . . 0.0 114.57 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 68.0 t -109.34 100.62 42.11 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.21 24.62 0.26 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.909 3.74 . . . . 0.0 115.545 -170.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.31 -8.65 2.25 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.662 2.385 . . . . 0.0 112.554 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.7 mtp180 -147.13 73.08 1.29 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.31 2.244 . . . . 0.0 105.274 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -57.31 -13.11 2.92 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.451 -0.781 . . . . 0.0 112.273 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.12 162.48 24.74 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -123.65 27.68 7.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.471 0.709 . . . . 0.0 112.248 -174.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.586 2.354 . . . . 0.0 110.488 177.133 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -139.19 57.46 1.66 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.519 0.676 . . . . 0.0 109.471 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.1 m -46.35 132.39 10.24 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 110.03 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -87.7 155.98 19.67 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.577 0.751 . . . . 0.0 109.571 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -136.01 169.85 12.5 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.683 1.993 . . . . 0.0 107.753 -176.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -58.23 163.44 10.1 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.248 1.299 . . . . 0.0 110.026 155.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -46.4 136.19 15.44 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.372 2.715 . . . . 0.0 113.884 -177.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t -120.99 84.12 38.7 Favored Pre-proline 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.81 28.83 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.642 3.562 . . . . 0.0 114.032 -171.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -130.5 -2.65 4.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.916 2.486 . . . . 0.0 111.464 169.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -132.22 -40.31 1.02 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.375 0.989 . . . . 0.0 112.006 171.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 61.84 -26.48 0.05 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.416 2.686 . . . . 0.0 115.3 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.61 -174.97 1.87 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -123.37 176.06 6.36 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 110.331 -176.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 C--O 1.25 1.123 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 173.834 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.12 171.48 5.59 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.067 0.46 . . . . 0.0 111.032 176.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -132.98 67.58 1.53 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.935 1.294 . . . . 0.0 108.358 -172.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.32 153.49 26.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -147.88 171.98 5.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 125.877 1.671 . . . . 0.0 108.426 -170.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.22 151.0 4.68 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 122.166 1.911 . . . . 0.0 111.656 157.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -49.66 146.0 16.24 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.83 3.02 . . . . 0.0 115.51 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HB3' HD21 ' A' ' 16' ' ' LEU . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 ' HB3' ' A' ' 13' ' ' LEU . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t -108.3 91.15 7.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.39 26.2 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.798 3.665 . . . . 0.0 114.78 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -131.29 -1.43 3.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.398 2.279 . . . . 0.0 111.992 169.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -133.84 -41.97 0.83 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.297 0.953 . . . . 0.0 112.086 173.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 58.83 -23.9 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.886 2.874 . . . . 0.0 115.754 -173.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.09 153.23 42.73 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.06 106.12 12.56 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--O 1.249 1.043 0 C-N-CA 124.107 0.963 . . . . 0.0 108.907 -179.043 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.075 0 CA-C-O 119.526 -0.274 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -151.51 160.62 43.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.204 1.401 . . . . 0.0 108.587 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 m -145.46 143.13 29.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -74.53 140.78 44.72 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -148.07 164.65 21.19 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 125.198 1.399 . . . . 0.0 108.379 -174.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.09 158.45 5.03 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.666 2.244 . . . . 0.0 111.867 161.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.29 140.08 20.87 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.556 2.837 . . . . 0.0 113.576 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.2 t -118.08 85.98 25.14 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.02 28.44 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 124.569 3.513 . . . . 0.0 114.333 -170.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -130.27 -2.52 4.45 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.817 2.447 . . . . 0.0 111.486 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -132.65 -40.36 0.97 Allowed 'General case' 0 C--N 1.346 0.422 0 CA-C-N 119.239 0.927 . . . . 0.0 111.93 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 60.72 -24.47 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.659 2.784 . . . . 0.0 115.273 -177.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.427 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.97 178.17 6.47 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -128.68 116.64 19.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 -177.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 172.536 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo . . . . . 0 N--CA 1.459 -0.522 0 N-CA-C 113.587 0.572 . . . . 0.0 113.587 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.736 1.754 . . . . 0.0 115.736 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo . . . . . 0 CA--C 1.533 0.459 0 N-CA-C 115.143 1.17 . . . . 0.0 115.143 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 . . . . . 0 CA--C 1.537 0.462 0 N-CA-C 116.147 1.906 . . . . 0.0 116.147 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo . . . . . 0 N--CA 1.459 -0.523 0 N-CA-C 114.117 0.776 . . . . 0.0 114.117 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' C ' HD12 ' A' ' 13' ' ' LEU . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' H ' HD13 ' A' ' 40' ' ' LEU . 45.4 t . . . . . 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 CA--C 1.536 0.433 0 N-CA-C 115.8 1.778 . . . . 0.0 115.8 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo . . . . . 0 N--CA 1.459 -0.525 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 . . . . . 0 CA--C 1.542 0.637 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo . . . . . 0 CA--C 1.535 0.558 0 N-CA-C 115.048 1.134 . . . . 0.0 115.048 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 115.935 1.828 . . . . 0.0 115.935 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.474 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo . . . . . 0 N--CA 1.458 -0.578 0 N-CA-C 114.696 0.999 . . . . 0.0 114.696 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t . . . . . 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo . . . . . 0 N--CA 1.453 -0.869 0 CA-C-O 121.564 0.568 . . . . 0.0 112.862 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' C ' HD12 ' A' ' 13' ' ' LEU . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.42 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo . . . . . 0 N--CA 1.458 -0.564 0 CA-C-O 120.623 0.176 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 . . . . . 0 CA--C 1.541 0.606 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 N--CA 1.458 -0.569 0 CA-C-O 121.097 0.374 . . . . 0.0 112.024 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.439 HG22 HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 . . . . . 0 CA--C 1.536 0.439 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 14' ' ' THR . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo . . . . . 0 CA--C 1.537 0.658 0 N-CA-C 114.323 0.855 . . . . 0.0 114.323 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.1 t . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 115.629 1.714 . . . . 0.0 115.629 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.46 -0.491 0 N-CA-C 113.656 0.598 . . . . 0.0 113.656 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.401 ' C ' HD12 ' A' ' 13' ' ' LEU . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo . . . . . 0 N--CA 1.459 -0.524 0 N-CA-C 113.203 0.424 . . . . 0.0 113.203 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo . . . . . 0 N--CA 1.458 -0.572 0 N-CA-C 114.417 0.891 . . . . 0.0 114.417 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 t . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 . . . . . 0 CA--C 1.537 0.479 0 N-CA-C 115.462 1.652 . . . . 0.0 115.462 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 72' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 71' ' ' THR . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo . . . . . 0 N--CA 1.459 -0.535 0 N-CA-C 114.563 0.947 . . . . 0.0 114.563 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.421 HG22 HG22 ' A' ' 47' ' ' ILE . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 . . . . . 0 CA--C 1.536 0.438 0 N-CA-C 115.642 1.719 . . . . 0.0 115.642 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo . . . . . 0 N--CA 1.457 -0.667 0 N-CA-C 114.101 0.769 . . . . 0.0 114.101 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 . . . . . 0 CA--C 1.542 0.649 0 N-CA-C 114.807 1.41 . . . . 0.0 114.807 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo . . . . . 0 N--CA 1.461 -0.435 0 N-CA-C 113.851 0.674 . . . . 0.0 113.851 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.409 ' H ' HD13 ' A' ' 40' ' ' LEU . 25.7 t . . . . . 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 . . . . . 0 CA--C 1.541 0.634 0 N-CA-C 115.802 1.778 . . . . 0.0 115.802 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo . . . . . 0 N--CA 1.456 -0.716 0 N-CA-C 114.57 0.95 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 68.0 t . . . . . 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 . . . . . 0 CA--C 1.54 0.589 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo . . . . . 0 N--CA 1.459 -0.534 0 N-CA-C 113.884 0.686 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t . . . . . 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 . . . . . 0 CA--C 1.537 0.471 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo . . . . . 0 CA--C 1.534 0.519 0 N-CA-C 115.51 1.311 . . . . 0.0 115.51 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HB3' HD21 ' A' ' 16' ' ' LEU . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 ' HB3' ' A' ' 13' ' ' LEU . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t . . . . . 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 115.754 1.761 . . . . 0.0 115.754 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo . . . . . 0 N--CA 1.459 -0.537 0 N-CA-C 113.576 0.568 . . . . 0.0 113.576 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 . . . . . 0 CA--C 1.537 0.463 0 N-CA-C 115.273 1.583 . . . . 0.0 115.273 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.427 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -64.13 157.02 26.61 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 120.859 0.361 . . . . 0.0 110.441 178.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 16.9 p -139.99 171.88 13.55 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.875 1.67 . . . . 0.0 107.272 169.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -134.94 161.31 35.64 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 171.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -152.23 171.54 6.53 Favored Pre-proline 0 CA--C 1.541 0.601 0 C-N-CA 127.053 2.141 . . . . 0.0 107.298 -171.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -57.95 161.53 12.92 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 N-CA-C 109.543 -0.983 . . . . 0.0 109.543 150.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_exo -47.14 138.26 16.84 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 122.958 2.439 . . . . 0.0 113.587 -178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.3 t30 -142.1 148.12 37.85 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 125.114 1.365 . . . . 0.0 107.603 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -72.64 7.8 1.74 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.884 1.274 . . . . 0.0 114.165 -176.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mt -134.79 138.19 49.7 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 178.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.7 mp -122.45 147.39 46.39 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 126.651 1.98 . . . . 0.0 107.034 -175.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -114.5 137.02 52.37 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 170.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.0 mp -127.09 144.18 51.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 124.657 1.183 . . . . 0.0 108.247 -169.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 30.3 p -141.93 175.28 9.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.465 1.106 . . . . 0.0 110.567 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.6 t30 54.47 33.96 19.95 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.773 1.629 . . . . 0.0 112.556 -176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -83.34 163.85 48.22 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.193 0.997 . . . . 0.0 108.773 177.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -49.18 148.63 9.78 Favored 'Trans proline' 0 N--CA 1.455 -0.762 0 C-N-CA 122.871 2.381 . . . . 0.0 111.505 169.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -73.05 8.1 1.76 Allowed 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.145 -0.972 . . . . 0.0 111.406 172.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -136.66 11.8 3.18 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.916 2.087 . . . . 0.0 111.035 -173.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.1 m -58.15 146.81 32.16 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 123.971 0.908 . . . . 0.0 109.616 179.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -136.34 157.12 47.56 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.165 0.986 . . . . 0.0 108.536 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -47.97 -43.1 29.18 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.099 1.359 . . . . 0.0 111.435 177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.3 -37.06 85.78 Favored 'General case' 0 N--CA 1.456 -0.161 0 C-N-CA 123.288 0.635 . . . . 0.0 111.404 -177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.4 mtp -64.68 -54.07 37.47 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 14.6 mt -71.89 -32.19 67.18 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.288 -175.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 36.2 m -62.63 -47.3 84.34 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 118.86 0.754 . . . . 0.0 109.233 173.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 47.9 tpp -57.52 -38.35 74.52 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 121.333 -0.855 . . . . 0.0 110.742 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.0 mt -72.15 -57.47 4.22 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.24 0.473 . . . . 0.0 111.611 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -80.35 -26.05 38.88 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -169.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -63.78 -12.73 37.9 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 120.584 1.538 . . . . 0.0 113.078 -178.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -57.94 -30.33 65.87 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.869 0.868 . . . . 0.0 111.45 171.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -85.89 135.7 37.34 Favored Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.96 32.53 0.37 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.653 3.568 . . . . 0.0 113.454 -175.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -136.65 -8.6 1.45 Allowed Glycine 0 C--N 1.336 0.535 0 CA-C-O 118.133 -1.371 . . . . 0.0 113.134 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -53.65 150.67 6.84 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-N 119.439 1.619 . . . . 0.0 110.98 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.59 -56.69 1.21 Allowed 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.917 0.887 . . . . 0.0 108.897 171.043 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -165.45 176.22 8.41 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.581 0.628 . . . . 0.0 110.972 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.6 m -135.47 166.02 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 124.768 1.227 . . . . 0.0 108.715 169.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.7 tpt85 -139.79 106.24 5.31 Favored 'General case' 0 CA--C 1.52 -0.194 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 171.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.07 172.45 11.01 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 170.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 48.9 t -112.24 92.01 17.73 Favored Pre-proline 0 C--N 1.328 -0.351 0 N-CA-C 105.286 -2.116 . . . . 0.0 105.286 169.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.01 27.07 0.3 Allowed 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 124.809 3.673 . . . . 0.0 114.827 -170.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.0 p30 -133.22 -2.05 3.18 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 127.504 2.321 . . . . 0.0 112.152 169.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 21.0 mtp180 -134.92 -42.02 0.74 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 119.53 1.059 . . . . 0.0 112.141 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 11.6 m80 59.79 -23.51 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.934 2.894 . . . . 0.0 115.736 -175.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -75.12 -5.51 44.65 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 119.705 1.139 . . . . 0.0 112.334 -174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.65 155.77 40.6 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 C-N-CA 125.876 1.67 . . . . 0.0 108.499 169.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -155.63 173.46 16.68 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 125.252 1.421 . . . . 0.0 109.391 -177.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -128.33 151.02 49.81 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 169.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 88.4 t -134.72 141.84 42.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 N-CA-C 106.177 -1.786 . . . . 0.0 106.177 -177.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -129.82 136.45 49.59 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 125.379 1.472 . . . . 0.0 108.046 -171.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -136.32 165.31 26.08 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.481 1.912 . . . . 0.0 110.268 -170.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.0 m -71.38 -48.13 51.92 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.905 1.682 . . . . 0.0 110.595 -178.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.35 142.96 35.52 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 122.47 1.129 . . . . 0.0 109.424 -168.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.45 -37.39 75.35 Favored 'General case' 0 C--N 1.324 -0.521 0 C-N-CA 125.542 1.537 . . . . 0.0 110.693 -174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 9.9 mp -69.01 -41.52 77.66 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.57 0.748 . . . . 0.0 110.918 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -69.24 -36.07 76.8 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 118.366 0.53 . . . . 0.0 109.888 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.8 m -58.61 -45.1 89.88 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.466 0.706 . . . . 0.0 110.61 172.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -62.08 -43.35 99.02 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 122.972 0.509 . . . . 0.0 111.341 176.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.49 -43.32 97.12 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.921 -0.487 . . . . 0.0 111.416 176.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.81 -39.46 90.92 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 122.983 0.513 . . . . 0.0 111.255 177.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -58.4 -51.92 67.79 Favored 'General case' 0 C--N 1.338 0.084 0 C-N-CA 123.594 0.757 . . . . 0.0 109.364 174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -58.93 -37.96 77.86 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 118.167 0.44 . . . . 0.0 110.744 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.2 -38.46 72.06 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.923 0.889 . . . . 0.0 113.095 -176.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.7 mt -116.14 -1.63 12.39 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -169.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -57.56 129.78 43.4 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 120.282 1.401 . . . . 0.0 108.929 169.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.2 5.56 89.06 Favored Glycine 0 CA--C 1.533 1.193 0 C-N-CA 124.918 1.247 . . . . 0.0 113.506 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -71.18 122.12 19.6 Favored 'General case' 0 C--O 1.231 0.099 0 CA-C-N 119.375 1.587 . . . . 0.0 109.21 -175.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.36 106.94 1.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 172.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 85.9 mt -68.63 -45.63 81.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.8 p -134.32 163.08 53.73 Favored Pre-proline 0 CA--C 1.534 0.359 0 N-CA-C 106.073 -1.825 . . . . 0.0 106.073 168.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_exo -47.73 -20.54 1.9 Allowed 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 124.59 3.527 . . . . 0.0 117.825 -169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.4 p -121.16 10.92 10.79 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.997 1.319 . . . . 0.0 112.303 -174.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -132.67 73.37 1.52 Allowed 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.167 0.987 . . . . 0.0 109.208 -173.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 106.39 1.91 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.458 169.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -49.58 111.49 0.51 Allowed 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 126.308 1.843 . . . . 0.0 111.879 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 41.7 mtmt -88.29 144.95 26.12 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 168.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.28 141.97 41.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 -178.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.28 153.33 40.44 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 126.519 1.928 . . . . 0.0 107.438 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -73.33 127.01 31.45 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 119.534 1.061 . . . . 0.0 108.677 176.042 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.91 -173.48 3.54 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 169.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.9 mtmm -133.58 156.06 48.52 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.308 1.043 . . . . 0.0 109.367 -172.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt . . . . . 0 C--O 1.247 0.968 0 C-N-CA 126.489 1.916 . . . . 0.0 107.102 176.554 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 CA-C-O 119.605 -0.236 . . . . 0.0 110.419 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -151.75 154.53 36.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.211 1.405 . . . . 0.0 107.913 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.7 p -82.16 55.82 2.97 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.125 1.37 . . . . 0.0 110.453 -177.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -62.61 149.28 43.75 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.0 mm-40 -146.0 172.33 5.41 Favored Pre-proline 0 CA--C 1.539 0.535 0 C-N-CA 126.299 1.84 . . . . 0.0 107.829 -171.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -57.13 158.72 17.07 Favored 'Trans proline' 0 CA--C 1.548 1.202 0 C-N-CA 121.419 1.413 . . . . 0.0 110.861 159.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_exo -48.88 144.18 15.78 Favored 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 124.031 3.154 . . . . 0.0 115.143 -174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.4 t30 -147.71 150.46 34.35 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 125.863 1.665 . . . . 0.0 107.772 173.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -74.46 6.5 3.67 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.038 1.335 . . . . 0.0 113.531 -175.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.6 mt -133.44 143.25 39.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.1 mt -125.61 145.44 50.14 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.922 1.689 . . . . 0.0 107.291 -174.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -111.42 137.99 48.5 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 169.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.9 mp -126.38 147.65 49.73 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.394 1.078 . . . . 0.0 108.729 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 7.4 p -145.64 172.15 13.68 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.278 1.831 . . . . 0.0 110.294 -171.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 39.0 t30 53.42 25.03 4.31 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 126.65 1.98 . . . . 0.0 113.579 -179.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 18.1 mt -73.05 167.66 32.18 Favored Pre-proline 0 CA--C 1.543 0.693 0 C-N-CA 124.243 1.017 . . . . 0.0 109.209 178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -49.09 159.7 0.96 Allowed 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.641 2.894 . . . . 0.0 113.981 170.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -73.96 0.61 12.98 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.475 -0.766 . . . . 0.0 111.621 169.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -138.45 12.68 2.77 Favored 'General case' 0 N--CA 1.443 -0.784 0 C-N-CA 126.394 1.877 . . . . 0.0 113.021 -169.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.44 145.07 23.57 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 124.055 0.942 . . . . 0.0 109.387 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -135.68 157.19 47.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 178.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -49.51 -37.86 28.28 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.908 1.283 . . . . 0.0 111.504 178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 17.3 tpt -60.29 -39.6 87.5 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 124.192 0.997 . . . . 0.0 111.743 179.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 79.9 mtp -64.73 -53.56 45.35 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 121.713 0.768 . . . . 0.0 109.047 -175.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.3 mt -72.51 -35.39 68.11 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.562 -0.732 . . . . 0.0 110.358 -173.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.2 p -64.52 -47.82 77.44 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 118.997 0.817 . . . . 0.0 109.488 178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 21.1 ptt? -64.16 -31.29 72.44 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 118.919 0.781 . . . . 0.0 111.423 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 68.5 mt -70.22 -57.97 4.31 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 119.236 0.926 . . . . 0.0 111.322 176.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.1 m-85 -76.66 -25.38 53.68 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -171.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 50.0 t30 -65.12 -12.08 47.04 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 120.022 1.283 . . . . 0.0 113.208 -176.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -56.76 -29.96 63.13 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.482 -0.761 . . . . 0.0 111.611 171.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.2 m-85 -85.35 135.0 39.39 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -75.41 35.35 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.109 0 C-N-CA 124.671 3.581 . . . . 0.0 113.467 -172.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.28 -7.15 0.59 Allowed Glycine 0 CA--C 1.522 0.496 0 CA-C-O 117.808 -1.551 . . . . 0.0 113.601 179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -56.1 151.18 12.62 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.852 1.826 . . . . 0.0 110.279 175.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.7 mtmt -134.04 -48.91 0.8 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-O 117.714 -1.136 . . . . 0.0 112.201 171.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -156.07 164.96 37.78 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 119.876 1.216 . . . . 0.0 112.748 -169.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.7 t -128.92 149.43 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 C-N-CA 127.182 2.193 . . . . 0.0 108.192 172.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 81.5 mtt85 -134.29 96.1 3.53 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 169.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.25 170.81 6.57 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.058 0.943 . . . . 0.0 108.658 172.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.3 t -119.39 86.4 33.53 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -72.32 28.07 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.87 0 C-N-CA 125.091 3.86 . . . . 0.0 114.418 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -129.74 -5.5 4.61 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.445 2.298 . . . . 0.0 111.753 169.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.5 mtp180 -129.46 -36.15 1.69 Allowed 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.764 1.166 . . . . 0.0 112.911 170.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.9 m170 58.22 -24.14 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 128.134 2.573 . . . . 0.0 116.147 -174.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -79.19 -3.5 46.01 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 120.141 1.337 . . . . 0.0 111.702 -175.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.6 pt -133.26 160.09 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.474 0 C-N-CA 127.273 2.229 . . . . 0.0 109.351 176.246 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.64 179.57 5.96 Favored 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 124.48 1.112 . . . . 0.0 110.246 176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -132.44 153.78 50.51 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.918 1.287 . . . . 0.0 107.578 169.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 30.6 t -139.31 146.63 25.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.7 tt0 -134.28 142.84 47.44 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.683 1.193 . . . . 0.0 109.451 -173.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.8 m-85 -133.28 166.0 23.5 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 127.525 2.33 . . . . 0.0 110.559 -169.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 86.9 m -68.28 -46.28 70.78 Favored 'General case' 0 C--N 1.327 -0.383 0 C-N-CA 126.036 1.734 . . . . 0.0 110.654 176.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.35 146.03 37.9 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 110.398 -169.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -60.28 -33.92 73.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.581 1.553 . . . . 0.0 111.287 -175.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.25 -34.38 74.72 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 121.88 -0.512 . . . . 0.0 110.546 178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -80.68 -38.56 28.75 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-O 118.403 -0.808 . . . . 0.0 110.684 -176.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.4 p -62.24 -39.99 94.7 Favored 'General case' 0 CA--C 1.529 0.142 0 CA-C-N 119.414 1.006 . . . . 0.0 109.947 169.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -57.23 -51.21 70.26 Favored 'General case' 0 C--O 1.227 -0.125 0 CA-C-N 118.363 0.528 . . . . 0.0 111.12 174.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.57 -42.38 96.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.235 0.47 . . . . 0.0 111.355 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.42 96.28 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.009 0.524 . . . . 0.0 111.6 177.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -58.97 -54.96 41.3 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 123.648 0.779 . . . . 0.0 109.067 174.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 51.6 mm-40 -61.98 -31.35 71.7 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.49 0.586 . . . . 0.0 110.818 -176.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.83 -39.93 66.19 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.932 0.893 . . . . 0.0 113.195 178.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.8 mt -111.41 -4.25 14.94 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 -169.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -57.73 127.39 31.78 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.249 1.386 . . . . 0.0 108.141 168.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.7 0.89 87.66 Favored Glycine 0 CA--C 1.535 1.289 0 C-N-CA 124.851 1.215 . . . . 0.0 113.93 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -71.17 122.03 19.42 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 119.507 1.654 . . . . 0.0 109.583 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -64.63 107.57 1.45 Allowed 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.0 mt -72.76 -41.92 61.73 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 169.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -136.46 151.06 72.31 Favored Pre-proline 0 CA--C 1.538 0.514 0 N-CA-C 105.462 -2.051 . . . . 0.0 105.462 171.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -45.84 -20.36 0.7 Allowed 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 124.806 3.67 . . . . 0.0 119.613 -169.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -125.11 21.47 8.08 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 120.244 1.383 . . . . 0.0 110.949 -179.761 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -135.66 76.14 1.6 Allowed 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.423 1.489 . . . . 0.0 108.1 -178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.65 113.99 6.63 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 169.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -49.47 131.25 20.81 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.43 1.492 . . . . 0.0 110.309 173.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -115.44 145.21 42.78 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 169.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 43.9 mt -136.7 142.55 37.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 -170.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.5 m -137.86 152.61 49.24 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 127.178 2.191 . . . . 0.0 105.825 174.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.0 m-85 -70.77 131.0 43.17 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 107.167 -1.42 . . . . 0.0 107.167 169.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.55 172.61 11.7 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 107.616 -1.253 . . . . 0.0 107.616 169.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -126.96 106.92 9.63 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 -174.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt . . . . . 0 C--O 1.249 1.055 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 173.141 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.984 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -57.63 128.13 35.51 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.367 0.667 . . . . 0.0 110.458 178.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.3 p -72.55 159.36 34.04 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.932 0.893 . . . . 0.0 110.633 -179.101 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -141.52 154.79 45.71 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 -177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.1 mm-40 -145.91 170.77 7.38 Favored Pre-proline 0 CA--C 1.538 0.51 0 C-N-CA 124.803 1.241 . . . . 0.0 109.579 -171.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -59.44 164.34 11.19 Favored 'Trans proline' 0 CA--C 1.546 1.115 0 C-N-CA 121.504 1.47 . . . . 0.0 110.164 153.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -47.12 134.57 18.93 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.478 2.786 . . . . 0.0 114.117 -177.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -146.57 145.48 30.12 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 126.077 1.751 . . . . 0.0 107.317 177.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -70.24 10.0 0.51 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.052 1.341 . . . . 0.0 114.59 -175.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.5 mt -134.19 141.22 44.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 105.593 -2.003 . . . . 0.0 105.593 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 73.4 mt -124.54 151.93 44.1 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 126.077 1.751 . . . . 0.0 107.604 -175.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' C ' HD12 ' A' ' 13' ' ' LEU . 63.2 t80 -122.1 136.24 54.89 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 170.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.452 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.4 mp -131.53 152.58 50.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.017 0.927 . . . . 0.0 108.571 -169.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 39.8 p -144.97 178.35 8.1 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 126.127 1.771 . . . . 0.0 109.84 -174.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 41.4 t30 53.34 29.41 8.62 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.392 1.877 . . . . 0.0 113.253 -176.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.8 mt -75.26 167.72 34.15 Favored Pre-proline 0 CA--C 1.543 0.704 0 C-N-CA 124.109 0.964 . . . . 0.0 108.955 174.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -48.95 160.44 0.7 Allowed 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.368 2.712 . . . . 0.0 113.129 169.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -78.39 7.21 6.88 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 120.93 -1.107 . . . . 0.0 110.736 169.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.9 mm-40 -137.61 9.1 2.87 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 126.01 1.724 . . . . 0.0 111.983 -169.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.97 145.9 34.3 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 123.894 0.877 . . . . 0.0 109.584 -177.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -127.77 153.45 46.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 176.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.96 -39.54 59.46 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.94 1.296 . . . . 0.0 111.47 -179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 77.7 mtm -64.48 -33.95 77.08 Favored 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 124.414 1.086 . . . . 0.0 112.656 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 90.8 mtp -62.55 -54.93 32.51 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.824 0.738 . . . . 0.0 109.375 -178.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.0 mt -69.18 -31.57 70.28 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 119.562 -0.855 . . . . 0.0 109.663 -179.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.5 m -58.8 -51.4 70.17 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 118.964 0.802 . . . . 0.0 110.235 176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.2 ptm -65.82 -31.7 72.81 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.022 0.828 . . . . 0.0 111.539 179.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.7 mt -67.1 -54.59 19.93 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-N 119.227 0.922 . . . . 0.0 111.234 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -79.31 -23.8 43.25 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -173.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -63.85 -12.36 35.57 Favored 'General case' 0 N--CA 1.468 0.469 0 O-C-N 120.575 -1.328 . . . . 0.0 113.396 -178.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -56.28 -29.86 61.72 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.466 -0.771 . . . . 0.0 111.816 171.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 -85.09 136.84 37.82 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 -179.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -74.08 29.69 0.33 Allowed 'Trans proline' 0 CA--C 1.546 1.106 0 C-N-CA 124.597 3.531 . . . . 0.0 113.448 -174.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.81 -5.54 0.9 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.783 -1.565 . . . . 0.0 113.474 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -56.68 149.93 16.83 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 119.926 1.863 . . . . 0.0 110.345 174.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -129.55 -55.07 1.16 Allowed 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.058 0.943 . . . . 0.0 110.225 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -160.58 176.84 11.13 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 119.295 0.952 . . . . 0.0 112.436 -172.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 97.3 t -138.21 152.25 25.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 C-N-CA 127.266 2.226 . . . . 0.0 107.054 174.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.68 105.67 7.66 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 168.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.474 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -73.84 170.11 16.01 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 108.11 -1.071 . . . . 0.0 108.11 173.539 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' H ' HD13 ' A' ' 40' ' ' LEU . 45.4 t -120.27 85.64 36.8 Favored Pre-proline 0 C--N 1.328 -0.329 0 N-CA-C 104.633 -2.358 . . . . 0.0 104.633 172.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -73.64 29.88 0.31 Allowed 'Trans proline' 0 CA--C 1.544 1.011 0 C-N-CA 124.653 3.569 . . . . 0.0 113.924 -171.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -129.12 -6.36 4.9 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 127.64 2.376 . . . . 0.0 111.328 169.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.4 mtp180 -128.52 -35.83 1.92 Allowed 'General case' 0 C--N 1.349 0.558 0 CA-C-N 119.722 1.146 . . . . 0.0 112.424 169.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 60.16 -24.37 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 128.18 2.592 . . . . 0.0 115.8 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -80.69 -2.47 46.85 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.544 1.066 . . . . 0.0 111.918 -177.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 pt -133.51 160.71 42.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 C-N-CA 126.253 1.821 . . . . 0.0 109.78 177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -164.11 175.75 9.92 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.329 1.052 . . . . 0.0 110.687 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.39 151.8 48.33 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 125.343 1.457 . . . . 0.0 107.189 169.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 46.1 t -135.63 147.07 28.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.383 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -134.29 140.47 46.43 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.067 1.347 . . . . 0.0 108.704 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -135.82 163.83 29.31 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 126.285 1.834 . . . . 0.0 111.204 -170.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.8 m -62.16 -49.25 76.57 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.923 2.089 . . . . 0.0 110.388 173.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.78 153.97 42.94 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 122.182 0.991 . . . . 0.0 110.363 -169.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -64.71 -34.36 78.13 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.892 1.677 . . . . 0.0 110.691 -175.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.37 -38.14 68.61 Favored 'General case' 0 C--N 1.338 0.101 0 O-C-N 121.846 -0.534 . . . . 0.0 110.487 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -74.21 -39.82 62.88 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 118.312 0.505 . . . . 0.0 110.199 -178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.7 p -62.4 -38.67 90.54 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-O 118.898 -0.572 . . . . 0.0 110.912 170.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -60.66 -46.54 89.96 Favored 'General case' 0 C--N 1.34 0.178 0 CA-C-N 119.349 0.977 . . . . 0.0 111.4 174.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.12 98.05 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.83 -0.544 . . . . 0.0 111.27 176.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.1 -40.11 95.5 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.159 0.584 . . . . 0.0 111.28 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -59.86 -51.19 70.79 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.954 0.902 . . . . 0.0 109.324 175.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -59.26 -37.88 78.7 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.274 0.488 . . . . 0.0 110.851 179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.09 -38.72 72.4 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.914 0.886 . . . . 0.0 112.95 -177.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.0 mt -113.22 -3.84 13.82 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -169.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -53.92 123.3 12.12 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 120.131 1.332 . . . . 0.0 109.044 167.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.36 3.14 90.65 Favored Glycine 0 CA--C 1.534 1.232 0 CA-C-O 118.798 -1.001 . . . . 0.0 113.732 179.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -68.18 122.77 19.0 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 119.528 1.664 . . . . 0.0 108.827 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.1 mptt -64.82 110.31 2.37 Favored 'General case' 0 C--O 1.232 0.177 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 96.7 mt -69.49 -46.63 75.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 N-CA-C 105.104 -2.184 . . . . 0.0 105.104 169.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.7 p -133.78 163.48 50.84 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 106.259 -1.756 . . . . 0.0 106.259 168.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -48.11 -19.5 1.69 Allowed 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.807 3.671 . . . . 0.0 117.974 -169.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.2 p -121.24 10.59 10.66 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.07 1.348 . . . . 0.0 112.075 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 62.9 m80 -134.08 71.95 1.46 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 123.989 0.915 . . . . 0.0 109.772 -173.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.74 108.82 3.56 Favored 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 169.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 14.2 ptp -57.99 143.92 41.41 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.334 0.515 . . . . 0.0 110.984 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -111.85 145.81 38.81 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 105.668 -1.975 . . . . 0.0 105.668 169.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.1 mt -132.11 147.02 32.28 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 N-CA-C 107.386 -1.338 . . . . 0.0 107.386 -173.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -144.89 148.28 33.75 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 127.598 2.359 . . . . 0.0 105.827 178.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -72.99 126.78 30.75 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 170.745 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -78.86 -172.59 3.11 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 169.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -118.05 176.97 4.96 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 124.263 1.025 . . . . 0.0 110.356 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp . . . . . 0 C--O 1.247 0.957 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 170.927 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 119.427 -0.32 . . . . 0.0 110.357 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 3.7 mm-40 -147.75 161.45 41.21 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.322 1.449 . . . . 0.0 108.844 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.1 p -144.01 166.1 25.91 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.378 1.471 . . . . 0.0 108.891 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -135.02 146.69 49.25 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 107.28 -1.378 . . . . 0.0 107.28 173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.5 mm-40 -153.48 167.39 13.65 Favored Pre-proline 0 CA--C 1.539 0.521 0 C-N-CA 126.417 1.887 . . . . 0.0 108.463 -171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -61.28 164.66 14.41 Favored 'Trans proline' 0 CA--C 1.548 1.187 0 C-N-CA 122.141 1.894 . . . . 0.0 110.964 161.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_exo -47.96 143.12 14.14 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 124.05 3.167 . . . . 0.0 114.919 -178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -146.83 150.23 34.87 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.085 1.754 . . . . 0.0 107.45 174.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -73.77 10.34 1.16 Allowed 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.501 1.121 . . . . 0.0 113.247 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.1 mt -136.14 139.79 45.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 105.135 -2.172 . . . . 0.0 105.135 179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.2 mp -125.71 148.84 48.92 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 127.194 2.197 . . . . 0.0 107.129 -171.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.8 t80 -117.05 141.36 48.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 105.776 -1.935 . . . . 0.0 105.776 170.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.5 mp -131.35 142.75 50.13 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 -169.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 28.2 p -141.11 176.16 9.05 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.838 1.255 . . . . 0.0 109.64 -178.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.3 t30 54.92 29.15 11.6 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.8 1.64 . . . . 0.0 113.265 -178.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.3 mt -77.55 162.62 67.85 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 124.024 0.93 . . . . 0.0 109.193 176.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -49.88 148.03 13.42 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.936 2.424 . . . . 0.0 111.097 169.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.95 5.87 2.41 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.372 -0.83 . . . . 0.0 111.773 174.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -132.92 10.97 4.28 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 126.608 1.963 . . . . 0.0 111.004 -174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -60.74 142.43 55.89 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 179.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -134.47 163.99 28.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 107.221 -1.4 . . . . 0.0 107.221 174.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -49.84 -37.15 29.45 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.702 1.601 . . . . 0.0 111.7 -177.639 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 65.1 ttp -58.02 -44.37 87.26 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.227 1.011 . . . . 0.0 111.615 -178.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -63.73 -52.95 58.18 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-O 121.534 0.683 . . . . 0.0 109.317 -173.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 29.3 mt -72.15 -32.1 66.58 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 118.61 -0.709 . . . . 0.0 110.429 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m -60.86 -47.86 84.44 Favored 'General case' 0 C--N 1.338 0.087 0 CA-C-N 119.048 0.84 . . . . 0.0 109.061 174.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 28.3 ttt -58.89 -42.14 88.84 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.268 0.627 . . . . 0.0 110.46 178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.6 mt -70.28 -52.15 25.07 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.577 0.626 . . . . 0.0 111.956 -178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -83.57 -28.22 28.71 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.843 0.683 . . . . 0.0 112.843 -170.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -65.73 -10.63 38.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.367 1.439 . . . . 0.0 112.532 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -56.73 -32.65 65.75 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.589 0.756 . . . . 0.0 111.275 169.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -83.2 135.2 44.72 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 177.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -74.88 32.37 0.36 Allowed 'Trans proline' 0 CA--C 1.546 1.108 0 C-N-CA 124.53 3.487 . . . . 0.0 113.306 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.89 -6.51 0.8 Allowed Glycine 0 C--N 1.335 0.517 0 CA-C-O 117.687 -1.618 . . . . 0.0 113.501 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.89 149.36 15.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 119.743 1.771 . . . . 0.0 109.388 172.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 13.3 ttpp -137.97 -41.88 0.53 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.512 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.3 tt0 -164.45 172.98 12.66 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.816 1.189 . . . . 0.0 110.001 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.5 p -151.63 149.35 14.02 Favored 'Isoleucine or valine' 0 C--O 1.233 0.237 0 C-N-CA 125.844 1.658 . . . . 0.0 107.077 169.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 88.4 mtm-85 -139.6 108.51 5.99 Favored 'General case' 0 N--CA 1.454 -0.234 0 N-CA-C 106.179 -1.786 . . . . 0.0 106.179 -175.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -72.85 169.41 16.87 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 107.926 -1.139 . . . . 0.0 107.926 170.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.3 t -108.39 100.13 36.13 Favored Pre-proline 0 CA--C 1.535 0.402 0 N-CA-C 104.147 -2.538 . . . . 0.0 104.147 169.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -73.53 25.61 0.32 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 124.385 3.39 . . . . 0.0 115.228 -169.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -136.83 -7.19 1.88 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.938 2.495 . . . . 0.0 112.543 169.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 41.4 mmm-85 -144.3 63.63 1.32 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.719 2.408 . . . . 0.0 104.965 173.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 66.0 m-70 -56.04 -13.71 2.13 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.493 0.717 . . . . 0.0 112.549 -178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.05 -3.26 34.9 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.505 1.122 . . . . 0.0 111.978 177.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.43 162.13 38.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 C-N-CA 124.794 1.238 . . . . 0.0 110.234 171.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -161.94 173.85 13.9 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 124.459 1.104 . . . . 0.0 110.745 -179.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -128.43 142.47 51.09 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 169.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 67.6 t -128.6 148.5 33.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 N-CA-C 106.053 -1.832 . . . . 0.0 106.053 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -139.77 142.03 36.76 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.758 0.823 . . . . 0.0 109.253 -169.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -134.21 167.01 21.47 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.193 1.797 . . . . 0.0 110.924 -169.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 75.2 m -67.84 -47.3 69.39 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 126.092 1.757 . . . . 0.0 111.234 172.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -143.24 147.65 35.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.544 0.688 . . . . 0.0 110.605 -169.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -62.52 -32.33 73.24 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.712 1.605 . . . . 0.0 111.32 -174.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -69.39 -38.69 78.11 Favored 'General case' 0 C--O 1.232 0.15 0 O-C-N 121.736 -0.603 . . . . 0.0 109.947 177.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -76.55 -39.37 53.01 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 118.778 -0.629 . . . . 0.0 110.34 -177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.4 p -63.02 -38.84 92.81 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 119.004 0.82 . . . . 0.0 110.714 171.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -59.23 -46.72 87.73 Favored 'General case' 0 C--N 1.339 0.141 0 CA-C-N 118.739 0.7 . . . . 0.0 111.262 174.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.98 -42.72 94.8 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.066 0.394 . . . . 0.0 111.282 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.74 96.35 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.947 0.499 . . . . 0.0 111.685 177.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? -57.45 -52.16 66.52 Favored 'General case' 0 C--N 1.337 0.042 0 C-N-CA 124.685 1.194 . . . . 0.0 108.762 174.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -60.09 -38.06 81.79 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.307 0.503 . . . . 0.0 110.76 -179.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.79 -37.9 67.41 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.984 0.914 . . . . 0.0 113.139 -176.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 67.2 mt -113.39 -4.16 13.66 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.88 1.067 . . . . 0.0 113.88 -169.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -56.55 128.82 38.12 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 120.353 1.433 . . . . 0.0 108.935 168.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.34 2.84 89.67 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 124.636 1.112 . . . . 0.0 113.654 179.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -68.91 122.21 18.17 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 119.633 1.716 . . . . 0.0 108.925 -177.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -64.54 109.27 1.92 Allowed 'General case' 0 N--CA 1.462 0.138 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 171.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.7 mt -69.08 -46.08 78.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 104.791 -2.3 . . . . 0.0 104.791 169.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.4 p -134.41 162.77 55.68 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 106.245 -1.761 . . . . 0.0 106.245 168.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_exo -47.92 -18.28 1.06 Allowed 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 124.935 3.757 . . . . 0.0 118.422 -169.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -123.17 12.14 9.53 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.498 1.119 . . . . 0.0 112.211 -175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 59.0 m80 -133.64 74.46 1.56 Allowed 'General case' 0 C--O 1.235 0.29 0 C-N-CA 123.962 0.905 . . . . 0.0 109.271 -173.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.63 109.04 3.11 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 114.867 -1.06 . . . . 0.0 108.348 169.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 45.8 ttm -49.33 113.43 0.81 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 126.298 1.839 . . . . 0.0 112.035 176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -89.68 138.06 31.8 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.58 -2.378 . . . . 0.0 104.58 168.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 48.0 mt -131.76 142.77 42.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 105.201 -2.148 . . . . 0.0 105.201 179.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 21.3 p -142.27 160.56 40.0 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 125.912 1.685 . . . . 0.0 106.988 169.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -72.32 127.53 32.84 Favored 'General case' 0 C--O 1.234 0.261 0 O-C-N 121.056 -1.027 . . . . 0.0 108.568 171.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.93 177.61 6.17 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 169.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm -128.82 167.29 17.55 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 124.211 1.004 . . . . 0.0 109.613 -171.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.1 mtmm . . . . . 0 C--O 1.248 0.978 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -175.236 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -65.87 151.65 46.22 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 122.924 0.489 . . . . 0.0 110.079 175.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.99 157.4 28.73 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 175.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -78.13 142.44 38.05 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 104.485 -2.413 . . . . 0.0 104.485 167.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -148.09 169.6 9.0 Favored Pre-proline 0 C--O 1.237 0.41 0 C-N-CA 124.965 1.306 . . . . 0.0 108.321 -169.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_exo -47.15 144.19 9.33 Favored 'Trans proline' 0 CA--C 1.544 1.017 0 C-N-CA 121.838 1.692 . . . . 0.0 110.507 154.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -50.23 146.45 18.12 Favored 'Trans proline' 0 CA--C 1.535 0.558 0 C-N-CA 123.384 2.722 . . . . 0.0 115.048 -174.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -140.34 150.09 43.54 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.692 1.597 . . . . 0.0 107.619 171.129 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -77.18 8.85 3.53 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.382 1.073 . . . . 0.0 112.938 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.3 mt -133.32 138.82 50.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.7 mp -125.08 150.57 46.69 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 126.941 2.096 . . . . 0.0 107.308 -173.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -118.27 135.66 54.15 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.1 mp -125.93 146.88 49.66 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 125.108 1.363 . . . . 0.0 108.191 -169.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.474 HG22 HG22 ' A' ' 47' ' ' ILE . 0.3 OUTLIER -146.28 171.43 14.98 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 125.399 1.48 . . . . 0.0 110.5 -170.429 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.2 t30 54.91 29.63 12.47 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.137 1.775 . . . . 0.0 112.604 -178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.7 161.05 73.15 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.256 1.022 . . . . 0.0 109.122 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -48.76 146.76 10.83 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.326 2.684 . . . . 0.0 111.9 169.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -70.92 5.45 1.99 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.737 0.815 . . . . 0.0 112.605 172.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -131.04 12.7 5.18 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 127.138 2.175 . . . . 0.0 111.376 -177.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.1 m -59.87 146.6 41.46 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.547 -0.721 . . . . 0.0 109.418 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -137.71 160.83 38.14 Favored 'General case' 0 N--CA 1.453 -0.318 0 N-CA-C 107.331 -1.359 . . . . 0.0 107.331 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -55.75 -36.57 67.45 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.996 0.918 . . . . 0.0 111.252 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 35.5 mmt -61.17 -35.85 78.25 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 123.116 0.566 . . . . 0.0 111.814 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.19 -55.28 22.85 Favored 'General case' 0 N--CA 1.464 0.229 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -179.188 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 37.5 mt -69.29 -33.34 73.03 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-O 118.944 -0.55 . . . . 0.0 110.493 -175.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 m -63.33 -46.0 88.67 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 55.1 ttm -58.59 -41.44 85.78 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.811 0.444 . . . . 0.0 110.543 176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 84.0 mt -70.08 -52.35 24.54 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 118.299 0.499 . . . . 0.0 111.903 -177.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 43.3 m-85 -82.62 -24.86 33.64 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -172.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -64.96 -13.64 57.91 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.244 1.383 . . . . 0.0 113.154 -175.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -57.22 -29.36 63.67 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.527 -0.733 . . . . 0.0 111.741 172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.6 m-85 -85.31 133.7 42.03 Favored Pre-proline 0 CA--C 1.536 0.427 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 -179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -75.3 37.1 0.48 Allowed 'Trans proline' 0 CA--C 1.547 1.155 0 C-N-CA 124.742 3.628 . . . . 0.0 113.455 -172.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.73 -7.57 0.53 Allowed Glycine 0 CA--C 1.523 0.57 0 CA-C-O 117.702 -1.61 . . . . 0.0 113.492 178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -56.82 150.03 17.11 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 120.146 1.973 . . . . 0.0 110.411 175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -129.48 -57.53 1.13 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.779 169.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -154.64 171.23 19.83 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 119.328 0.967 . . . . 0.0 111.419 -169.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.2 m -135.31 166.25 28.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 C-N-CA 125.044 1.338 . . . . 0.0 108.095 168.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -139.88 108.22 5.82 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 171.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -75.56 170.22 16.58 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 171.627 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t -112.82 92.1 19.65 Favored Pre-proline 0 C--N 1.328 -0.343 0 N-CA-C 105.381 -2.081 . . . . 0.0 105.381 169.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -72.42 28.13 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.854 0 C-N-CA 124.721 3.614 . . . . 0.0 113.968 -175.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 64.4 m-80 -126.48 -8.47 6.3 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 127.866 2.467 . . . . 0.0 111.161 171.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.2 mtp180 -137.39 -38.78 0.6 Allowed 'General case' 0 C--N 1.346 0.435 0 CA-C-N 119.357 0.98 . . . . 0.0 112.607 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.9 m170 58.53 -24.42 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 128.863 2.865 . . . . 0.0 115.935 -172.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -75.99 -6.28 50.23 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 120.247 1.385 . . . . 0.0 112.562 -174.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.474 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.47 156.99 42.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 125.128 1.371 . . . . 0.0 109.409 171.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.97 175.27 14.31 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.304 1.442 . . . . 0.0 109.653 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -126.98 152.94 46.53 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 124.963 1.305 . . . . 0.0 107.743 169.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.57 145.28 30.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 N-CA-C 106.403 -1.702 . . . . 0.0 106.403 -178.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -136.63 139.11 41.83 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 124.39 1.076 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -130.62 167.49 18.66 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 127.613 2.365 . . . . 0.0 110.257 -170.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 81.8 m -69.81 -46.01 66.63 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 126.188 1.795 . . . . 0.0 110.634 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.76 145.12 35.96 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 121.735 0.779 . . . . 0.0 109.594 -169.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -63.01 -34.85 78.44 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.836 1.654 . . . . 0.0 110.354 -171.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 28.4 mt -72.72 -31.5 65.03 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.389 -178.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -78.24 -39.09 41.34 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.484 178.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.3 p -63.76 -37.68 88.28 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.345 0.975 . . . . 0.0 110.703 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -59.21 -47.99 83.29 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 118.784 0.72 . . . . 0.0 110.983 173.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -58.78 -43.31 90.41 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 121.915 -0.491 . . . . 0.0 111.312 176.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.84 -39.18 93.56 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 122.94 0.496 . . . . 0.0 111.793 177.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 46.3 tttm -58.15 -54.74 43.56 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 173.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -61.21 -33.1 72.92 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.344 0.52 . . . . 0.0 110.702 -176.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.8 -38.13 67.33 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.115 0.966 . . . . 0.0 113.326 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -114.9 -3.74 12.68 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.287 1.218 . . . . 0.0 114.287 -169.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -57.38 127.13 30.46 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 120.366 1.439 . . . . 0.0 108.612 168.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.1 0.14 88.88 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.83 1.205 . . . . 0.0 113.736 -179.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -68.87 121.86 17.44 Favored 'General case' 0 C--O 1.231 0.131 0 CA-C-N 119.635 1.718 . . . . 0.0 109.488 -176.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.42 108.28 1.59 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 171.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 75.3 mt -68.93 -45.9 79.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 169.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.8 p -133.88 163.0 54.29 Favored Pre-proline 0 CA--C 1.534 0.343 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 167.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.05 -20.41 2.13 Favored 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 124.507 3.471 . . . . 0.0 117.606 -169.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.2 p -121.01 10.95 10.89 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.114 1.366 . . . . 0.0 112.28 -174.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -133.35 73.7 1.53 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.169 0.988 . . . . 0.0 109.014 -173.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.97 109.04 2.8 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 169.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.6 ttm -48.61 121.05 4.16 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 126.026 1.73 . . . . 0.0 111.17 175.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -99.82 142.97 30.6 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.331 -2.1 . . . . 0.0 105.331 169.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 53.5 mt -134.12 144.18 36.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 105.741 -1.948 . . . . 0.0 105.741 -176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -145.16 159.46 42.95 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 127.092 2.157 . . . . 0.0 106.493 173.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -74.52 138.59 43.24 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 171.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.18 153.02 40.87 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 169.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 45.4 mtpt -122.89 93.99 4.13 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 -169.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt . . . . . 0 C--O 1.248 0.991 0 C-N-CA 125.202 1.401 . . . . 0.0 109.221 -177.464 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.045 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -153.01 167.15 30.17 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.183 1.393 . . . . 0.0 108.66 177.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -150.44 137.31 19.19 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -173.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -85.29 144.84 27.84 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 168.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -148.37 169.97 8.4 Favored Pre-proline 0 CA--C 1.537 0.476 0 C-N-CA 125.812 1.645 . . . . 0.0 107.904 -170.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_exo -48.67 148.6 8.26 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.038 1.825 . . . . 0.0 111.128 158.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -50.5 146.39 19.62 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.466 2.777 . . . . 0.0 114.696 -176.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.0 t30 -147.15 149.38 32.87 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.749 1.62 . . . . 0.0 107.707 174.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -72.88 7.14 2.15 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.237 1.015 . . . . 0.0 113.546 -176.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 11.3 mt -134.0 141.2 44.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 105.652 -1.981 . . . . 0.0 105.652 -178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.6 mt -125.18 147.19 49.16 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 125.788 1.635 . . . . 0.0 107.372 -174.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -115.89 137.08 52.44 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 106.171 -1.789 . . . . 0.0 106.171 170.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -129.37 149.22 51.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 124.467 1.107 . . . . 0.0 109.151 -169.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.9 p -144.19 177.09 8.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.408 1.483 . . . . 0.0 110.429 -175.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 47.0 t30 53.83 27.81 7.6 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 126.331 1.852 . . . . 0.0 113.388 -178.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.28 168.18 30.25 Favored Pre-proline 0 CA--C 1.541 0.617 0 C-N-CA 124.846 1.258 . . . . 0.0 109.028 177.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -47.91 158.81 0.73 Allowed 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.552 2.835 . . . . 0.0 112.945 169.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -77.49 7.59 5.29 Favored 'General case' 0 CA--C 1.541 0.622 0 O-C-N 121.011 -1.056 . . . . 0.0 110.583 169.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -140.12 11.4 2.39 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.121 1.769 . . . . 0.0 111.881 -169.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.93 145.19 30.84 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.734 0.814 . . . . 0.0 109.203 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.2 t30 -136.64 157.21 47.31 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -58.4 -35.5 72.13 Favored 'General case' 0 N--CA 1.464 0.265 0 C-N-CA 123.534 0.733 . . . . 0.0 110.601 -173.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -59.01 -38.36 79.06 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.332 1.053 . . . . 0.0 111.847 178.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.0 mtt -62.66 -56.08 21.05 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 122.084 0.945 . . . . 0.0 109.294 -179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 19.0 mt -69.59 -29.6 67.17 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.071 -176.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.3 m -61.8 -51.69 67.23 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 119.034 0.834 . . . . 0.0 109.337 174.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.4 ptt? -65.52 -24.83 67.22 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.333 0.969 . . . . 0.0 112.023 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -74.29 -58.38 3.33 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-N 119.011 0.823 . . . . 0.0 111.583 173.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -80.14 -24.9 40.12 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.886 0.698 . . . . 0.0 112.886 -171.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 21.1 p-10 -65.72 -9.15 25.41 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 120.215 1.371 . . . . 0.0 113.202 -178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.8 mt-30 -60.34 -32.52 71.34 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.127 0.971 . . . . 0.0 110.891 170.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -80.69 140.51 51.19 Favored Pre-proline 0 CA--C 1.538 0.485 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 -178.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -74.45 22.29 0.39 Allowed 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 124.555 3.503 . . . . 0.0 114.986 -169.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -147.03 0.8 0.73 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-O 118.349 -1.251 . . . . 0.0 114.386 -176.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -55.97 150.63 13.16 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.158 1.479 . . . . 0.0 109.492 172.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.3 mtmp? -131.17 -49.67 1.01 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 117.553 -1.213 . . . . 0.0 111.529 172.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -158.8 170.69 21.58 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 120.036 1.289 . . . . 0.0 113.159 -169.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.1 t -132.41 149.29 32.13 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 C-N-CA 127.378 2.271 . . . . 0.0 107.134 172.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -132.01 109.71 10.22 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 106.155 -1.795 . . . . 0.0 106.155 169.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.0 173.69 10.37 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.649 0.738 . . . . 0.0 109.517 174.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 46.6 t -122.3 84.66 46.83 Favored Pre-proline 0 N--CA 1.453 -0.306 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 169.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -73.76 27.35 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 124.475 3.45 . . . . 0.0 114.354 -169.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.4 p30 -125.79 -6.07 6.84 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 127.516 2.327 . . . . 0.0 111.309 169.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -128.3 -38.43 1.77 Allowed 'General case' 0 C--N 1.347 0.469 0 CA-C-N 119.44 1.018 . . . . 0.0 112.438 169.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 42.2 m80 60.57 -23.39 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 128.008 2.523 . . . . 0.0 115.606 -178.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.4 p-10 -80.23 -0.96 38.58 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 119.595 1.089 . . . . 0.0 111.739 -179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.7 pt -134.02 160.19 41.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 C-N-CA 126.516 1.926 . . . . 0.0 109.225 175.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.87 176.03 9.86 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 124.284 1.034 . . . . 0.0 110.371 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -129.1 151.44 49.78 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.924 1.29 . . . . 0.0 107.583 169.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 39.3 t -137.31 148.24 26.21 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 106.762 -1.569 . . . . 0.0 106.762 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -137.18 144.15 42.75 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 124.11 0.964 . . . . 0.0 110.243 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -131.17 169.28 16.13 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 128.335 2.654 . . . . 0.0 110.154 -171.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.1 m -72.08 -49.55 35.49 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.985 0.914 . . . . 0.0 110.683 173.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.6 p -127.61 156.07 42.88 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 122.492 1.139 . . . . 0.0 110.281 -176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.1 -29.5 70.37 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.046 -1.888 . . . . 0.0 111.312 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -71.62 -41.15 69.23 Favored 'General case' 0 CA--C 1.529 0.141 0 O-C-N 121.77 -0.581 . . . . 0.0 109.714 178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -72.46 -41.02 66.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 118.741 -0.647 . . . . 0.0 109.821 -176.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.7 p -63.08 -41.25 99.38 Favored 'General case' 0 C--N 1.34 0.174 0 CA-C-N 119.004 0.82 . . . . 0.0 110.345 172.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.8 -50.11 69.32 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.005 0.82 . . . . 0.0 111.391 176.023 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.42 -36.19 76.45 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.498 -0.481 . . . . 0.0 111.717 -177.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.82 -41.85 97.77 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.602 -0.686 . . . . 0.0 111.218 174.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.8 tmtt? -58.56 -52.95 63.47 Favored 'General case' 0 CA--C 1.521 -0.169 0 C-N-CA 124.832 1.253 . . . . 0.0 108.948 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 2.3 pt-20 -64.0 -33.52 75.91 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 118.636 0.653 . . . . 0.0 110.801 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.76 -43.2 72.7 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.908 0.883 . . . . 0.0 112.777 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 53.2 mt -106.94 -2.61 21.06 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.092 1.145 . . . . 0.0 114.092 -169.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.73 127.37 31.2 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 120.398 1.454 . . . . 0.0 108.725 169.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.84 4.3 90.1 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.988 1.28 . . . . 0.0 113.782 -179.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.4 t80 -70.77 121.64 18.39 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 119.44 1.62 . . . . 0.0 109.411 -175.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.43 1.37 Allowed 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 172.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 74.9 mt -70.01 -43.23 79.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 N-CA-C 105.122 -2.177 . . . . 0.0 105.122 169.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 31.4 p -135.11 161.75 61.7 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 168.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -47.18 -22.57 2.38 Favored 'Trans proline' 0 C--N 1.35 0.624 0 C-N-CA 124.663 3.575 . . . . 0.0 117.781 -169.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -123.36 11.22 9.31 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.823 1.249 . . . . 0.0 112.094 -174.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -129.69 75.02 1.62 Allowed 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.493 1.117 . . . . 0.0 108.432 -176.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.57 108.61 2.93 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 114.564 -1.198 . . . . 0.0 108.379 169.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 43.5 ttm -49.07 115.26 1.22 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 126.126 1.771 . . . . 0.0 111.402 174.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 44.6 mtpt -93.52 144.24 25.54 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 105.383 -2.08 . . . . 0.0 105.383 168.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.1 mt -136.33 144.84 31.84 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -145.71 158.03 43.89 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.922 2.089 . . . . 0.0 106.708 174.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.2 m-85 -73.38 132.21 42.76 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.157 -1.053 . . . . 0.0 108.157 171.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -72.87 161.65 30.46 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 169.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.85 116.3 26.23 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 -178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm . . . . . 0 C--O 1.249 1.067 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 179.815 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -68.07 151.29 47.27 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -157.61 148.99 21.69 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 175.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -78.81 145.15 34.47 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 168.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -148.47 172.34 5.29 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 125.124 1.369 . . . . 0.0 108.681 -169.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -45.14 145.98 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 121.968 1.779 . . . . 0.0 110.47 152.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -66.76 153.6 77.38 Favored 'Trans proline' 0 N--CA 1.453 -0.869 0 C-N-CA 122.008 1.805 . . . . 0.0 112.862 -169.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t30 -144.85 149.1 34.8 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.479 1.911 . . . . 0.0 107.42 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -74.83 10.38 1.45 Allowed 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 114.066 1.136 . . . . 0.0 114.066 -175.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 19.4 mt -137.92 140.97 39.82 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 105.022 -2.214 . . . . 0.0 105.022 -178.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.5 mt -121.05 150.1 41.69 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 125.547 1.539 . . . . 0.0 107.63 -175.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' C ' HD12 ' A' ' 13' ' ' LEU . 72.7 t80 -122.22 136.7 54.95 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 171.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.42 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.94 152.83 48.98 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.094 0.958 . . . . 0.0 108.983 -169.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 46.4 p -142.24 178.41 7.58 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.066 1.347 . . . . 0.0 109.877 -179.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.9 t30 53.99 28.07 8.21 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.385 1.874 . . . . 0.0 113.832 -179.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.1 mt -73.89 164.16 63.17 Favored Pre-proline 0 CA--C 1.541 0.608 0 C-N-CA 124.514 1.126 . . . . 0.0 109.159 174.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_exo -50.01 150.02 10.71 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.855 2.37 . . . . 0.0 111.285 169.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.91 1.52 5.46 Favored 'General case' 0 CA--C 1.539 0.545 0 O-C-N 121.315 -0.866 . . . . 0.0 111.691 171.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -130.91 13.71 5.27 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 126.615 1.966 . . . . 0.0 110.973 -173.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 7.8 m -58.45 146.49 34.96 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.837 0.855 . . . . 0.0 109.191 178.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -133.32 155.83 48.72 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 176.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -48.51 -39.97 25.1 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.164 1.386 . . . . 0.0 111.958 179.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.6 mtt -62.29 -36.4 82.0 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-O 118.774 -0.631 . . . . 0.0 112.094 -178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 60.8 mtt -60.07 -56.62 19.37 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.935 0.874 . . . . 0.0 109.233 -176.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 17.9 mt -70.92 -31.45 68.07 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.05 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 49.9 m -60.59 -46.6 89.64 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 119.142 0.883 . . . . 0.0 110.006 176.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 97.1 mmm -61.26 -44.84 96.58 Favored 'General case' 0 N--CA 1.461 0.085 0 CA-C-N 118.462 0.574 . . . . 0.0 110.296 176.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.28 -49.18 70.53 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 111.693 0.257 . . . . 0.0 111.693 -175.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -85.54 -26.27 26.29 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.628 -0.701 . . . . 0.0 112.835 -173.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.88 -11.57 39.21 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 120.539 1.518 . . . . 0.0 112.551 -179.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -55.25 -31.39 61.49 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.746 0.819 . . . . 0.0 111.496 170.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 33.0 m-85 -87.36 136.1 33.79 Favored Pre-proline 0 CA--C 1.535 0.404 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 179.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.25 32.05 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.112 0 C-N-CA 124.614 3.542 . . . . 0.0 113.561 -173.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -138.34 -7.17 1.3 Allowed Glycine 0 CA--C 1.523 0.574 0 CA-C-O 118.078 -1.401 . . . . 0.0 113.193 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -56.26 149.36 16.46 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 119.459 1.63 . . . . 0.0 110.836 176.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 mtpt -131.33 -53.02 1.02 Allowed 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 117.871 -1.062 . . . . 0.0 111.452 172.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 tt0 -157.9 169.66 24.09 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.613 1.097 . . . . 0.0 112.442 -169.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 91.3 t -134.52 152.08 32.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 C-N-CA 127.097 2.159 . . . . 0.0 107.952 173.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 21.0 tpt85 -141.9 107.84 5.17 Favored 'General case' 0 CA--C 1.527 0.07 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 169.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.68 170.94 14.21 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 107.953 -1.128 . . . . 0.0 107.953 169.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 47.4 t -109.8 102.01 48.82 Favored Pre-proline 0 C--N 1.327 -0.37 0 N-CA-C 104.062 -2.569 . . . . 0.0 104.062 169.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.46 26.52 0.27 Allowed 'Trans proline' 0 CA--C 1.545 1.031 0 C-N-CA 124.564 3.509 . . . . 0.0 114.562 -173.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.8 m-80 -129.96 -15.16 3.86 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 128.169 2.587 . . . . 0.0 111.823 170.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 32.3 mtp180 -149.0 75.68 1.31 Allowed 'General case' 0 N--CA 1.449 -0.486 0 C-N-CA 127.52 2.328 . . . . 0.0 105.023 176.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 20.1 m80 -58.89 -12.43 4.46 Favored 'General case' 0 CA--C 1.541 0.624 0 O-C-N 121.58 -0.7 . . . . 0.0 112.04 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -73.59 -5.56 41.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.208 1.003 . . . . 0.0 112.005 -179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.54 160.57 41.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.934 1.294 . . . . 0.0 109.662 173.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.24 174.65 12.58 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.637 0.775 . . . . 0.0 111.2 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -126.88 151.26 48.65 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.657 1.583 . . . . 0.0 107.208 169.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 40.5 t -136.55 142.6 37.77 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.17 140.27 53.13 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.876 1.271 . . . . 0.0 108.313 -174.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -137.53 164.07 29.61 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 126.196 1.798 . . . . 0.0 110.337 -171.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 84.8 m -64.87 -48.49 74.08 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 126.698 1.999 . . . . 0.0 111.387 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.86 150.47 41.62 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 122.304 1.05 . . . . 0.0 109.933 -169.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.88 -38.92 87.3 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 125.205 1.402 . . . . 0.0 110.085 -174.545 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.52 -35.75 68.16 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 123.061 0.544 . . . . 0.0 111.241 -178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -71.11 -38.47 72.33 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 119.009 0.822 . . . . 0.0 109.859 175.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.0 m -56.19 -45.82 79.65 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.193 0.597 . . . . 0.0 110.405 170.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.0 t30 -60.08 -48.34 82.14 Favored 'General case' 0 C--O 1.224 -0.254 0 C-N-CA 122.736 0.414 . . . . 0.0 111.015 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.2 -42.22 98.21 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.314 0.507 . . . . 0.0 111.426 -179.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.66 -42.03 98.13 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.857 0.463 . . . . 0.0 111.176 176.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.7 tttm -57.0 -53.95 52.32 Favored 'General case' 0 C--O 1.226 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.306 174.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -62.71 -33.74 75.74 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 119.149 0.886 . . . . 0.0 111.113 -177.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -69.66 -39.83 76.8 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.65 0.78 . . . . 0.0 112.496 179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -111.72 -1.25 15.72 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -169.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -57.36 127.65 33.06 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 120.074 1.307 . . . . 0.0 108.925 172.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 76.97 9.51 86.68 Favored Glycine 0 CA--C 1.534 1.266 0 C-N-CA 124.587 1.089 . . . . 0.0 113.619 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -72.86 123.4 23.33 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 119.378 1.589 . . . . 0.0 109.024 -177.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 108.38 1.63 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 173.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 97.1 mt -70.85 -45.55 72.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 169.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -132.65 162.75 55.37 Favored Pre-proline 0 CA--C 1.533 0.326 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 168.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -48.36 -21.38 3.1 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 124.374 3.382 . . . . 0.0 117.454 -169.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.9 p -121.01 11.54 11.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.053 1.341 . . . . 0.0 112.161 -174.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -133.14 73.16 1.51 Allowed 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.206 1.003 . . . . 0.0 109.199 -175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.43 107.48 2.9 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 169.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 10.9 ptp -58.1 137.51 56.87 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 121.233 0.539 . . . . 0.0 110.32 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 47.6 mtpt -101.07 143.6 31.0 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 105.095 -2.187 . . . . 0.0 105.095 169.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.9 mt -133.46 140.07 47.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -178.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -144.76 162.52 36.53 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 127.056 2.143 . . . . 0.0 106.417 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -75.76 138.46 41.24 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 172.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -70.51 152.09 44.37 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 169.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 38.5 mtpt -120.73 91.14 3.46 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.04 -1.467 . . . . 0.0 107.04 -169.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm . . . . . 0 C--O 1.248 0.983 0 C-N-CA 124.259 1.024 . . . . 0.0 109.513 -175.829 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -57.63 124.74 20.11 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.398 0.679 . . . . 0.0 110.084 177.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 26.2 p -76.07 169.91 17.28 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.404 1.082 . . . . 0.0 110.001 -179.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -135.43 148.43 49.3 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 169.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -141.9 170.66 8.65 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 126.13 1.772 . . . . 0.0 107.857 -169.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -50.44 161.91 1.07 Allowed 'Trans proline' 0 CA--C 1.545 1.07 0 C-N-CA 122.084 1.856 . . . . 0.0 111.214 154.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -46.46 133.39 16.21 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.127 2.551 . . . . 0.0 112.494 175.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -142.25 133.74 26.59 Favored 'General case' 0 C--O 1.231 0.103 0 N-CA-C 107.251 -1.389 . . . . 0.0 107.251 -173.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -69.37 8.66 0.57 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 16.9 mt -132.14 137.78 53.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.404 0 N-CA-C 105.066 -2.198 . . . . 0.0 105.066 174.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 67.9 mt -119.72 148.64 43.16 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.854 1.662 . . . . 0.0 106.901 -177.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -114.33 137.85 51.28 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 170.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.2 mp -129.86 148.84 51.78 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.484 1.114 . . . . 0.0 109.509 -169.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 29.6 p -144.18 175.93 9.7 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.251 1.42 . . . . 0.0 110.383 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.8 t30 54.5 30.31 12.74 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 126.391 1.876 . . . . 0.0 113.181 -178.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 17.9 mt -78.31 164.27 57.33 Favored Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 124.289 1.036 . . . . 0.0 108.987 176.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -49.3 148.92 9.81 Favored 'Trans proline' 0 N--CA 1.456 -0.711 0 C-N-CA 122.965 2.443 . . . . 0.0 111.515 169.682 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -71.25 2.59 4.52 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 121.255 -0.903 . . . . 0.0 111.696 172.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -131.74 12.74 4.86 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 126.717 2.007 . . . . 0.0 111.073 -173.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.2 m -59.41 147.79 35.09 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.677 0.791 . . . . 0.0 109.504 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 47.0 t30 -137.05 160.22 39.58 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -49.69 -43.15 47.16 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.506 1.522 . . . . 0.0 111.006 179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -62.94 -35.97 81.87 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 123.337 0.655 . . . . 0.0 111.825 -177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 88.6 mtp -65.49 -54.28 30.49 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 -176.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.8 mt -72.16 -32.74 67.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 120.044 -0.662 . . . . 0.0 110.246 -175.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 47.0 m -62.11 -45.85 91.66 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 109.284 -0.635 . . . . 0.0 109.284 175.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 27.9 ttt -58.79 -43.84 90.56 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.909 0.484 . . . . 0.0 110.598 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 79.9 mt -67.3 -52.69 37.49 Favored 'General case' 0 C--N 1.339 0.146 0 CA-C-N 118.576 0.625 . . . . 0.0 111.506 -177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 48.8 m-85 -81.09 -26.02 36.56 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 112.856 0.688 . . . . 0.0 112.856 -172.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.7 t30 -64.7 -11.84 40.29 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 120.302 1.41 . . . . 0.0 112.699 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -56.59 -29.98 62.68 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.464 0.705 . . . . 0.0 111.647 170.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -88.56 138.58 29.91 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -75.77 34.96 0.43 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.706 3.604 . . . . 0.0 113.315 -173.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -144.06 -6.27 0.58 Allowed Glycine 0 C--N 1.336 0.533 0 CA-C-O 117.969 -1.462 . . . . 0.0 113.632 -179.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -55.56 149.75 13.3 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 119.743 1.771 . . . . 0.0 111.193 177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -129.71 -56.13 1.14 Allowed 'General case' 0 C--N 1.332 -0.19 0 C-N-CA 124.114 0.966 . . . . 0.0 109.948 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -162.03 174.3 13.21 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 119.274 0.943 . . . . 0.0 111.887 -171.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.9 166.23 26.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 125.086 1.354 . . . . 0.0 109.096 169.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 60.5 ttp180 -143.46 104.44 4.23 Favored 'General case' 0 C--O 1.231 0.082 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 174.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -73.34 166.68 22.73 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 169.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.8 t -108.03 102.2 44.83 Favored Pre-proline 0 CA--C 1.537 0.476 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -72.92 23.99 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 124.636 3.557 . . . . 0.0 115.392 -169.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -135.32 -8.19 2.25 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 127.678 2.391 . . . . 0.0 112.602 169.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 -146.75 72.03 1.26 Allowed 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.297 2.239 . . . . 0.0 105.128 171.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.7 m80 -58.27 -12.83 4.05 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.52 -0.737 . . . . 0.0 112.007 178.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -72.42 -4.93 33.08 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.539 1.135 . . . . 0.0 111.999 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -130.57 161.03 41.21 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 125.113 1.365 . . . . 0.0 109.595 171.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.2 176.57 9.84 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.485 1.114 . . . . 0.0 110.195 -178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -130.5 152.95 49.33 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 169.039 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 93.4 t -135.82 144.29 33.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.303 -1.739 . . . . 0.0 106.303 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -132.17 138.75 48.14 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 125.367 1.467 . . . . 0.0 108.368 -170.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -135.24 163.17 30.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.512 1.925 . . . . 0.0 111.372 -169.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 99.5 m -63.42 -48.5 77.53 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 127.318 2.247 . . . . 0.0 110.955 177.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -141.18 151.08 43.53 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.969 0.89 . . . . 0.0 109.723 -169.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -73.31 -24.47 60.4 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.411 -169.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 60.9 mt -74.6 -31.78 62.14 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.264 0.626 . . . . 0.0 110.642 173.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.3 mt-30 -80.8 -36.4 31.76 Favored 'General case' 0 C--O 1.231 0.127 0 CA-C-O 118.221 -0.895 . . . . 0.0 110.757 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 29.6 p -60.89 -41.33 95.79 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 119.641 1.109 . . . . 0.0 109.667 169.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -57.1 -47.89 79.96 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 122.877 0.471 . . . . 0.0 111.718 173.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.51 -43.63 96.89 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.209 0.459 . . . . 0.0 111.399 178.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.82 -38.09 87.99 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 122.819 0.448 . . . . 0.0 111.436 178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.78 -51.62 68.98 Favored 'General case' 0 C--O 1.228 -0.05 0 C-N-CA 123.919 0.888 . . . . 0.0 109.262 174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.6 -37.54 76.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.033 0.379 . . . . 0.0 110.665 179.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.19 -38.1 69.13 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.008 0.923 . . . . 0.0 113.379 -177.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 66.8 mt -116.16 -1.52 12.4 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -169.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.5 mt-30 -57.34 129.17 40.61 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 120.244 1.383 . . . . 0.0 108.733 169.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.71 4.32 90.28 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.028 1.299 . . . . 0.0 113.756 -179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -71.08 122.31 19.84 Favored 'General case' 0 C--O 1.231 0.092 0 CA-C-N 119.444 1.622 . . . . 0.0 109.513 -175.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.48 107.69 1.44 Allowed 'General case' 0 N--CA 1.463 0.2 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 171.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 84.8 mt -69.49 -45.26 78.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 169.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 41.5 p -134.3 162.85 55.18 Favored Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 106.117 -1.808 . . . . 0.0 106.117 168.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -47.64 -20.88 1.97 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 124.549 3.5 . . . . 0.0 117.816 -169.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.8 p -121.34 11.18 10.71 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.974 1.31 . . . . 0.0 112.251 -174.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 66.9 m80 -132.61 73.58 1.53 Allowed 'General case' 0 C--O 1.235 0.298 0 C-N-CA 124.15 0.98 . . . . 0.0 109.102 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.01 106.43 1.94 Allowed 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 169.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 46.1 ttm -47.99 122.49 5.16 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.919 1.687 . . . . 0.0 110.992 174.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.7 mtmt -102.82 145.88 29.11 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 168.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.0 mt -137.25 141.97 38.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -174.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -141.01 152.29 44.79 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 126.532 1.933 . . . . 0.0 107.56 177.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -72.32 122.5 21.24 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 173.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.2 -163.18 0.13 Allowed 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 43.0 mtpt -129.24 -177.2 4.14 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.952 1.301 . . . . 0.0 109.052 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm . . . . . 0 C--O 1.246 0.901 0 N-CA-C 106.649 -1.611 . . . . 0.0 106.649 175.703 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.032 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -67.08 149.64 50.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.82 0.448 . . . . 0.0 109.888 175.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 m -159.72 158.23 30.93 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 177.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -78.56 147.09 33.89 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -146.92 169.95 8.58 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.963 1.305 . . . . 0.0 108.016 -170.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -46.99 157.6 0.53 Allowed 'Trans proline' 0 CA--C 1.545 1.067 0 C-N-CA 122.311 2.008 . . . . 0.0 111.163 151.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.38 143.62 93.58 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 122.397 2.064 . . . . 0.0 112.024 -173.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -142.02 137.21 30.96 Favored 'General case' 0 C--O 1.23 0.077 0 N-CA-C 106.96 -1.496 . . . . 0.0 106.96 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -55.14 -24.96 28.94 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 126.363 1.865 . . . . 0.0 114.851 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 92.4 mt -120.92 144.97 28.17 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 -174.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.6 mt -116.76 148.78 40.83 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.864 1.666 . . . . 0.0 106.995 178.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -113.16 134.51 54.53 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.228 -1.767 . . . . 0.0 106.228 170.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.2 mp -125.94 149.1 49.01 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.739 1.216 . . . . 0.0 109.333 -169.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.439 HG22 HG22 ' A' ' 47' ' ' ILE . 0.5 OUTLIER -147.71 173.35 12.85 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.211 1.805 . . . . 0.0 110.379 -170.326 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 49.6 t30 54.66 27.08 8.16 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 125.989 1.716 . . . . 0.0 112.861 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 19.2 mt -76.19 168.17 30.25 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.441 1.096 . . . . 0.0 108.995 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -48.81 159.64 0.85 Allowed 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 123.297 2.664 . . . . 0.0 113.203 170.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -77.79 6.4 7.57 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.949 -1.095 . . . . 0.0 110.571 169.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -137.88 10.56 2.86 Favored 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 126.242 1.817 . . . . 0.0 111.855 -169.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.29 145.32 32.45 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.94 0.791 . . . . 0.0 109.235 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -133.43 157.45 45.56 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 176.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -52.15 -38.84 58.84 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 125.102 1.361 . . . . 0.0 110.833 -177.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 60.1 ttm -63.05 -36.41 83.48 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.067 0.947 . . . . 0.0 112.001 -179.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 61.8 mtt -62.82 -54.71 34.7 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 121.753 0.787 . . . . 0.0 108.956 -177.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 25.1 mt -70.35 -31.57 68.89 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 118.686 -0.673 . . . . 0.0 109.99 -176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.1 m -60.94 -52.21 65.97 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 118.741 0.7 . . . . 0.0 109.754 176.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.81 -28.78 68.65 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 118.454 -0.784 . . . . 0.0 111.454 -179.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 70.1 mt -69.36 -55.87 9.16 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.347 0.976 . . . . 0.0 111.137 175.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -78.74 -25.6 44.57 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -172.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -64.81 -13.1 54.44 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 119.873 1.215 . . . . 0.0 113.245 -176.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -58.06 -29.38 65.36 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.498 -0.751 . . . . 0.0 111.631 172.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -84.77 139.09 37.52 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -76.39 43.96 1.29 Allowed 'Trans proline' 0 CA--C 1.546 1.12 0 C-N-CA 124.902 3.734 . . . . 0.0 112.795 -174.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -153.53 -9.99 0.08 OUTLIER Glycine 0 C--N 1.334 0.455 0 CA-C-O 117.342 -1.81 . . . . 0.0 114.296 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -53.96 152.1 6.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 120.492 2.146 . . . . 0.0 111.132 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.75 -54.69 1.0 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 118.125 -0.94 . . . . 0.0 110.159 172.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -159.47 172.22 18.28 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 118.941 0.791 . . . . 0.0 112.466 -169.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 83.2 t -132.32 151.71 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 126.914 2.085 . . . . 0.0 107.711 172.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 33.3 ttt180 -132.81 97.07 3.94 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 169.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.64 168.56 10.97 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 108.096 -1.075 . . . . 0.0 108.096 169.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.06 86.45 37.19 Favored Pre-proline 0 C--N 1.328 -0.358 0 N-CA-C 104.955 -2.239 . . . . 0.0 104.955 170.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -73.67 27.42 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 124.694 3.596 . . . . 0.0 114.648 -170.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.1 p30 -130.02 -2.22 4.61 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 127.791 2.436 . . . . 0.0 111.411 169.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 19.3 mmm-85 -125.99 -45.39 1.72 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 124.621 1.169 . . . . 0.0 110.344 173.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 40.8 m80 63.14 -28.89 0.08 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.633 2.773 . . . . 0.0 115.01 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -78.56 -3.01 41.56 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.838 1.255 . . . . 0.0 111.701 178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 14' ' ' THR . 2.4 pt -132.15 160.38 42.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.365 0 C-N-CA 125.623 1.569 . . . . 0.0 110.193 175.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -165.49 179.64 6.01 Favored 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.691 1.196 . . . . 0.0 110.144 177.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -132.75 154.85 49.82 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 125.137 1.375 . . . . 0.0 107.385 169.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.0 t -137.27 145.63 29.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 106.891 -1.522 . . . . 0.0 106.891 179.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -127.89 139.3 52.69 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 125.386 1.474 . . . . 0.0 108.709 -173.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -127.72 166.73 17.59 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.942 1.697 . . . . 0.0 110.807 -176.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 88.3 m -69.01 -46.96 66.65 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 125.46 1.504 . . . . 0.0 109.977 177.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.27 138.03 44.71 Favored 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 123.972 0.909 . . . . 0.0 108.582 -169.135 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.79 -31.77 72.81 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 114.488 -1.233 . . . . 0.0 111.38 -171.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.44 -31.36 70.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.178 0.591 . . . . 0.0 110.862 175.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -80.63 -36.02 33.18 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 117.775 -1.107 . . . . 0.0 111.178 -179.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -61.32 -40.06 92.8 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 120.345 1.43 . . . . 0.0 109.195 169.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -54.59 -48.07 72.58 Favored 'General case' 0 C--N 1.341 0.197 0 O-C-N 121.914 -0.492 . . . . 0.0 111.994 170.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.83 -42.58 99.79 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 118.294 0.497 . . . . 0.0 111.053 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.45 87.46 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 122.905 0.482 . . . . 0.0 111.505 178.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 8.5 tmtt? -57.71 -53.1 61.96 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.179 0.991 . . . . 0.0 108.845 173.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.2 mm-40 -59.31 -37.71 78.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.138 0.427 . . . . 0.0 110.664 -179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.86 -38.44 70.08 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.08 0.952 . . . . 0.0 113.222 -176.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.7 mt -113.84 -2.67 13.58 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -169.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -55.11 126.97 26.94 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 120.443 1.474 . . . . 0.0 109.071 169.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.56 0.44 89.3 Favored Glycine 0 CA--C 1.534 1.257 0 C-N-CA 124.695 1.14 . . . . 0.0 113.906 179.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -67.32 121.97 16.87 Favored 'General case' 0 C--N 1.338 0.09 0 CA-C-N 119.523 1.662 . . . . 0.0 109.535 -177.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.54 108.46 1.68 Allowed 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 172.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 83.1 mt -68.54 -44.94 82.58 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 N-CA-C 105.049 -2.204 . . . . 0.0 105.049 169.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 26.7 p -136.42 163.42 50.03 Favored Pre-proline 0 CA--C 1.535 0.392 0 N-CA-C 106.141 -1.8 . . . . 0.0 106.141 168.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 66.2 Cg_exo -46.86 -20.57 1.16 Allowed 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.76 3.64 . . . . 0.0 118.373 -169.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -123.9 14.5 9.26 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 119.707 1.14 . . . . 0.0 111.288 -174.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 55.8 m80 -134.06 72.99 1.48 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 124.188 0.995 . . . . 0.0 108.931 -173.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.8 107.66 2.26 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 169.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.2 ttm -46.66 111.53 0.4 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.319 1.848 . . . . 0.0 111.188 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -90.54 140.79 29.41 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 105.262 -2.125 . . . . 0.0 105.262 169.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.8 mt -133.27 144.37 36.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -177.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.41 158.34 44.0 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 126.61 1.964 . . . . 0.0 106.457 172.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -76.03 137.2 40.07 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.18 -1.045 . . . . 0.0 108.18 172.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.74 177.32 5.55 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 107.277 -1.379 . . . . 0.0 107.277 168.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -129.74 86.24 2.39 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 -171.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt . . . . . 0 C--O 1.247 0.968 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 169.886 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -67.01 149.34 50.76 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.923 0.489 . . . . 0.0 109.725 175.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.5 m -159.63 155.87 26.93 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -77.49 143.52 38.42 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 104.935 -2.246 . . . . 0.0 104.935 167.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -146.68 167.51 13.63 Favored Pre-proline 0 C--O 1.237 0.409 0 C-N-CA 124.638 1.175 . . . . 0.0 108.262 -170.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -47.6 145.7 8.81 Favored 'Trans proline' 0 CA--C 1.545 1.056 0 C-N-CA 121.715 1.61 . . . . 0.0 110.149 153.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -49.48 143.6 20.57 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.152 2.568 . . . . 0.0 114.323 -174.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -140.76 150.08 42.93 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.923 1.689 . . . . 0.0 106.712 173.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -73.08 11.39 0.72 Allowed 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -141.95 140.91 29.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 105.877 -1.898 . . . . 0.0 105.877 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.91 154.37 37.21 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 125.679 1.592 . . . . 0.0 107.943 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 77.4 t80 -119.75 136.53 54.4 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 169.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -127.17 154.55 44.64 Favored 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 124.681 1.193 . . . . 0.0 109.262 -169.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.08 169.57 20.35 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 126.79 2.036 . . . . 0.0 110.046 -169.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.4 t30 60.72 18.3 8.42 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.21 1.804 . . . . 0.0 113.308 178.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 66.4 mt -64.7 156.75 77.42 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_exo -47.83 143.42 13.1 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.221 2.614 . . . . 0.0 111.011 169.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -68.71 3.96 1.66 Allowed 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.873 0.869 . . . . 0.0 113.104 177.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -124.8 7.97 8.14 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 127.122 2.169 . . . . 0.0 111.257 -177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -62.46 142.88 57.68 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.611 -0.681 . . . . 0.0 109.748 -175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.5 168.42 19.69 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.296 1.038 . . . . 0.0 108.202 173.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -49.7 -40.73 41.34 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.591 1.556 . . . . 0.0 112.62 -174.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 76.2 mtm -66.79 -34.12 77.11 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 119.208 -0.425 . . . . 0.0 111.413 -172.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 80.4 mtp -62.64 -55.46 26.77 Favored 'General case' 0 CA--C 1.52 -0.182 0 N-CA-C 109.757 -0.461 . . . . 0.0 109.757 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -73.19 -30.71 63.73 Favored 'General case' 0 C--N 1.331 -0.234 0 C-N-CA 119.911 -0.715 . . . . 0.0 110.505 -176.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.5 m -61.62 -46.68 88.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 118.844 0.747 . . . . 0.0 109.376 174.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 67.8 ttp -58.52 -43.6 89.24 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.237 0.615 . . . . 0.0 110.563 176.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 77.0 mt -67.89 -50.55 55.64 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.396 0.544 . . . . 0.0 111.62 -176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.1 m-85 -83.81 -25.67 30.19 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.318 0.858 . . . . 0.0 113.318 -172.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 48.5 t30 -65.32 -12.54 52.84 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 120.301 1.41 . . . . 0.0 113.074 -175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -57.12 -29.99 64.01 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.502 -0.749 . . . . 0.0 111.682 172.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 36.2 m-85 -84.4 135.29 41.42 Favored Pre-proline 0 CA--C 1.537 0.468 0 N-CA-C 107.964 -1.125 . . . . 0.0 107.964 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.18 33.99 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 124.649 3.566 . . . . 0.0 113.452 -172.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.08 -6.29 1.09 Allowed Glycine 0 C--N 1.336 0.572 0 CA-C-O 117.881 -1.51 . . . . 0.0 113.298 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 64.1 t80 -53.99 147.21 12.84 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 119.796 1.798 . . . . 0.0 111.552 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 30.8 mmmt -127.69 -58.05 1.25 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 118.185 -0.912 . . . . 0.0 109.999 173.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -161.24 166.44 27.71 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 119.227 0.921 . . . . 0.0 111.311 -171.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 m -133.68 156.17 41.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 168.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 59.8 mtt85 -140.8 95.27 2.83 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 -176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -66.18 169.05 7.58 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 123.989 0.916 . . . . 0.0 108.873 173.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 59.1 t -115.6 88.2 19.34 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 105.012 -2.218 . . . . 0.0 105.012 169.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -74.14 29.64 0.33 Allowed 'Trans proline' 0 CA--C 1.542 0.909 0 C-N-CA 124.525 3.484 . . . . 0.0 113.714 -171.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 16.4 p30 -123.93 -11.08 7.67 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 127.493 2.317 . . . . 0.0 111.031 169.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 55.6 mtm180 -128.76 -30.36 2.28 Favored 'General case' 0 C--N 1.35 0.599 0 CA-C-N 119.8 1.182 . . . . 0.0 113.237 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 74.5 m-70 57.21 -16.6 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 127.635 2.374 . . . . 0.0 115.629 -176.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -71.52 -15.61 62.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 120.364 1.438 . . . . 0.0 111.276 -179.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 pt -133.52 158.01 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 C-N-CA 124.931 1.292 . . . . 0.0 110.219 -169.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.62 175.59 12.51 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 123.758 0.823 . . . . 0.0 109.927 177.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -124.84 149.74 47.15 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 168.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.6 t -133.4 139.51 48.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 178.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -132.04 139.79 48.67 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 124.83 1.252 . . . . 0.0 108.144 -171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -137.73 166.19 24.57 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.239 1.816 . . . . 0.0 110.611 -169.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.2 m -64.19 -49.0 73.74 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 126.834 2.053 . . . . 0.0 110.814 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.21 150.11 40.56 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.275 1.036 . . . . 0.0 110.279 -169.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.28 -39.52 87.17 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 125.224 1.41 . . . . 0.0 110.479 -175.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.6 -39.67 80.78 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 122.976 0.51 . . . . 0.0 110.726 -178.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.0 mt-30 -70.7 -38.53 73.67 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 118.287 0.494 . . . . 0.0 110.053 177.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.2 m -55.92 -47.17 77.97 Favored 'General case' 0 CA--C 1.527 0.08 0 C-N-CA 123.442 0.697 . . . . 0.0 110.532 171.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -59.69 -48.23 82.49 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.334 0.654 . . . . 0.0 110.94 177.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.87 -43.51 98.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.256 0.48 . . . . 0.0 111.525 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.62 -42.4 95.53 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 122.953 0.501 . . . . 0.0 111.154 177.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -58.75 -50.6 73.33 Favored 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 124.455 1.102 . . . . 0.0 109.521 175.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -61.05 -38.58 86.68 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 118.71 0.686 . . . . 0.0 110.409 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -68.52 -41.45 79.93 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 123.799 0.839 . . . . 0.0 112.38 -178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.4 mt -107.59 -3.54 19.21 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -169.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -56.03 127.92 32.83 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 120.376 1.444 . . . . 0.0 108.831 169.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.77 4.57 88.18 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.726 1.155 . . . . 0.0 114.023 179.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -68.34 123.62 21.27 Favored 'General case' 0 C--N 1.339 0.149 0 CA-C-N 119.698 1.749 . . . . 0.0 109.167 -177.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.46 107.13 1.28 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.4 mt -70.04 -45.43 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 169.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 43.9 p -133.3 162.7 56.04 Favored Pre-proline 0 CA--C 1.535 0.369 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 168.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -48.55 -21.14 3.1 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 124.343 3.362 . . . . 0.0 117.493 -169.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.4 p -121.87 10.68 10.25 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.105 1.362 . . . . 0.0 111.968 -174.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.7 m-70 -130.72 75.9 1.69 Allowed 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.352 1.061 . . . . 0.0 109.31 -175.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.32 112.11 5.0 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.181 -1.414 . . . . 0.0 107.181 169.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 48.1 ttm -50.66 115.46 1.5 Allowed 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 126.151 1.78 . . . . 0.0 110.942 176.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -92.45 137.11 32.65 Favored 'General case' 0 C--O 1.232 0.148 0 N-CA-C 105.577 -2.009 . . . . 0.0 105.577 169.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 13.2 mt -131.37 145.96 34.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 105.713 -1.958 . . . . 0.0 105.713 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.34 157.56 44.67 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 126.877 2.071 . . . . 0.0 106.212 171.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.1 m-85 -70.93 133.97 46.85 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 121.182 -0.949 . . . . 0.0 108.505 171.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -76.34 171.49 14.47 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 168.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.2 mttt -125.73 167.68 14.82 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 123.967 0.907 . . . . 0.0 108.771 -174.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm . . . . . 0 C--O 1.25 1.115 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 -179.186 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -143.8 160.9 39.93 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.607 1.563 . . . . 0.0 108.148 177.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.4 p -143.01 172.01 13.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.763 1.625 . . . . 0.0 107.715 171.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -136.28 167.22 21.72 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.021 1.329 . . . . 0.0 108.812 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -151.07 174.4 3.58 Favored Pre-proline 0 CA--C 1.542 0.645 0 C-N-CA 127.319 2.248 . . . . 0.0 107.652 -173.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -57.8 165.3 6.64 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 121.14 1.226 . . . . 0.0 110.004 148.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -45.95 136.34 13.71 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.191 2.594 . . . . 0.0 113.656 -179.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 40.1 t30 -137.08 142.55 42.37 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 124.447 1.099 . . . . 0.0 108.571 -176.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.5 tt0 -55.68 -22.16 21.81 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 128.475 2.71 . . . . 0.0 114.977 -176.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -129.24 145.31 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 N-CA-C 106.107 -1.812 . . . . 0.0 106.107 -173.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 76.2 mt -122.43 149.35 43.95 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 125.916 1.686 . . . . 0.0 107.565 -172.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.401 ' C ' HD12 ' A' ' 13' ' ' LEU . 54.5 t80 -115.8 136.8 52.7 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 171.277 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.401 HD12 ' C ' ' A' ' 12' ' ' PHE . 9.8 mp -129.35 150.11 50.85 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.16 0.984 . . . . 0.0 108.946 -170.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 32.1 p -142.61 176.02 9.35 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.33 1.452 . . . . 0.0 110.381 -177.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.4 t30 53.72 29.56 9.71 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 126.909 2.084 . . . . 0.0 113.624 -178.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 34.7 mt -72.14 154.81 92.17 Favored Pre-proline 0 CA--C 1.539 0.54 0 C-N-CA 123.519 0.728 . . . . 0.0 109.132 175.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.37 146.43 18.84 Favored 'Trans proline' 0 N--CA 1.459 -0.509 0 C-N-CA 123.189 2.593 . . . . 0.0 110.887 169.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -64.96 -10.45 29.33 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.554 -0.716 . . . . 0.0 112.427 170.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -97.16 0.62 48.69 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.416 1.486 . . . . 0.0 112.165 -179.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.6 m -66.43 145.02 56.15 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 121.383 -0.823 . . . . 0.0 110.082 -171.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.7 t30 -138.42 164.36 29.54 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.297 -1.742 . . . . 0.0 106.297 169.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -55.74 -32.1 63.09 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 124.639 1.176 . . . . 0.0 111.638 -174.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 67.1 mtt -58.82 -39.8 82.27 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.616 0.767 . . . . 0.0 111.95 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mpt? -64.25 -53.22 52.49 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.782 0.801 . . . . 0.0 109.321 -176.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 42.0 mt -71.04 -31.59 68.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.732 -0.651 . . . . 0.0 110.128 -177.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.9 m -63.53 -46.42 86.07 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 119.027 0.831 . . . . 0.0 108.949 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -56.03 -47.3 78.07 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.339 0.656 . . . . 0.0 110.532 174.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.01 -51.0 60.41 Favored 'General case' 0 N--CA 1.462 0.131 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -175.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -80.66 -26.94 37.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 118.875 -0.583 . . . . 0.0 112.428 -172.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -64.41 -11.46 33.23 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 120.059 1.299 . . . . 0.0 112.742 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -56.99 -28.34 62.3 Favored 'General case' 0 CA--C 1.536 0.44 0 O-C-N 121.526 -0.734 . . . . 0.0 111.735 170.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -91.03 139.37 25.79 Favored Pre-proline 0 CA--C 1.536 0.405 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -75.36 31.78 0.37 Allowed 'Trans proline' 0 CA--C 1.546 1.124 0 C-N-CA 124.692 3.594 . . . . 0.0 113.536 -173.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.33 -5.46 0.97 Allowed Glycine 0 CA--C 1.523 0.577 0 CA-C-O 118.112 -1.382 . . . . 0.0 113.264 -178.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -58.16 149.69 23.25 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 119.544 1.672 . . . . 0.0 110.325 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -130.75 -54.01 1.07 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 117.154 -1.403 . . . . 0.0 110.918 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -163.05 175.39 11.14 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.57 1.532 . . . . 0.0 113.316 -172.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.2 t -136.48 152.54 29.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 126.285 1.834 . . . . 0.0 108.667 179.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.6 mmt-85 -135.17 109.88 8.63 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 169.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -76.2 169.69 17.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 169.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t -115.94 90.75 28.77 Favored Pre-proline 0 C--N 1.329 -0.297 0 N-CA-C 104.859 -2.274 . . . . 0.0 104.859 170.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -73.69 27.46 0.32 Allowed 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.951 3.1 . . . . 0.0 113.67 -174.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 68.4 m-80 -121.0 -11.41 8.91 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.941 2.496 . . . . 0.0 110.77 171.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -132.32 -34.01 1.25 Allowed 'General case' 0 C--N 1.346 0.418 0 CA-C-N 119.368 0.986 . . . . 0.0 112.816 173.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.6 m80 60.49 -23.14 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.22 2.608 . . . . 0.0 115.547 -178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -81.91 -2.58 51.74 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.879 1.218 . . . . 0.0 112.201 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.51 159.5 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 125.627 1.571 . . . . 0.0 109.789 177.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -162.33 177.92 9.15 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 124.175 0.99 . . . . 0.0 110.618 179.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 88.4 m-85 -129.82 151.85 49.95 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.623 1.569 . . . . 0.0 107.148 169.348 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -135.5 144.33 34.23 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 179.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -125.36 132.09 52.87 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 125.346 1.458 . . . . 0.0 107.839 -171.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 2.6 m-85 -128.47 164.88 21.78 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.333 1.453 . . . . 0.0 110.056 -175.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.3 m -64.53 -53.05 54.15 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.219 1.408 . . . . 0.0 110.363 178.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.71 149.45 47.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 122.154 0.978 . . . . 0.0 109.701 -169.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -62.32 -35.91 80.53 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 124.995 1.318 . . . . 0.0 110.592 -173.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -68.32 -40.12 81.76 Favored 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 123.232 0.613 . . . . 0.0 110.561 178.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.7 mt-30 -72.0 -34.73 69.11 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.585 0.629 . . . . 0.0 110.495 176.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -56.38 -47.58 78.62 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.392 0.677 . . . . 0.0 109.695 170.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.1 t30 -61.29 -44.47 97.16 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.356 0.662 . . . . 0.0 111.792 176.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.14 -44.1 97.86 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 118.53 0.605 . . . . 0.0 111.3 179.352 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.99 -39.6 90.45 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.748 0.419 . . . . 0.0 111.19 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -58.28 -51.9 67.86 Favored 'General case' 0 C--N 1.339 0.113 0 C-N-CA 123.389 0.676 . . . . 0.0 109.556 174.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -58.58 -38.47 77.97 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.494 0.588 . . . . 0.0 110.695 179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.11 -37.98 72.34 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.874 0.869 . . . . 0.0 113.145 -176.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 75.1 mt -115.29 -1.95 12.78 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 114.027 1.121 . . . . 0.0 114.027 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -57.83 130.15 45.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 120.028 1.285 . . . . 0.0 108.546 168.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 78.27 6.17 87.67 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.745 1.164 . . . . 0.0 113.576 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -71.5 123.22 21.94 Favored 'General case' 0 C--N 1.338 0.105 0 CA-C-N 119.401 1.6 . . . . 0.0 108.963 -176.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.24 110.08 2.09 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 171.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.8 mt -76.14 -43.17 37.95 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 105.435 -2.061 . . . . 0.0 105.435 169.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.6 m -133.01 151.6 78.24 Favored Pre-proline 0 CA--C 1.535 0.376 0 N-CA-C 104.902 -2.258 . . . . 0.0 104.902 169.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -47.92 -18.22 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.77 0 C-N-CA 124.401 3.401 . . . . 0.0 118.032 -169.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 21.1 p -114.72 3.91 14.86 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.538 1.535 . . . . 0.0 112.606 -175.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -134.72 76.62 1.64 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.892 1.277 . . . . 0.0 108.219 -169.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.75 113.29 5.4 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 114.24 -1.345 . . . . 0.0 107.801 169.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.8 ttm -50.46 130.87 24.38 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 125.406 1.482 . . . . 0.0 110.705 174.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 39.6 mtmt -110.16 143.7 39.87 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 168.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.3 mt -136.97 142.12 38.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 -174.792 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.63 153.64 41.25 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 126.457 1.903 . . . . 0.0 107.5 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -72.27 130.01 39.79 Favored 'General case' 0 C--O 1.234 0.276 0 O-C-N 121.295 -0.878 . . . . 0.0 108.694 176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -74.56 -178.3 3.52 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.211 0.529 . . . . 0.0 109.778 171.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -134.96 96.36 3.5 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 -171.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt . . . . . 0 C--O 1.251 1.141 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 172.789 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -64.23 145.34 56.15 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.9 p -145.74 154.11 41.7 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.325 1.45 . . . . 0.0 107.54 170.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -104.9 133.33 49.89 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.147 -1.797 . . . . 0.0 106.147 169.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -149.65 165.46 17.55 Favored Pre-proline 0 CA--C 1.538 0.497 0 C-N-CA 126.31 1.844 . . . . 0.0 107.651 -170.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -51.21 155.27 6.75 Favored 'Trans proline' 0 CA--C 1.545 1.075 0 C-N-CA 122.21 1.94 . . . . 0.0 111.351 159.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -48.12 140.15 19.88 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 123.512 2.808 . . . . 0.0 113.203 176.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -146.87 155.66 42.49 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.535 1.534 . . . . 0.0 107.316 176.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -80.07 11.65 3.29 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.919 1.451 . . . . 0.0 114.919 -170.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 28.4 mt -139.5 127.59 26.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 -178.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -105.04 153.9 20.86 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 119.383 0.992 . . . . 0.0 108.912 177.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -113.02 135.47 53.75 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.7 mp -127.95 150.89 49.7 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.149 0.98 . . . . 0.0 108.934 -169.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.8 p -143.15 175.83 9.57 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.466 1.506 . . . . 0.0 109.968 -178.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.3 t30 52.97 30.58 9.57 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 126.323 1.849 . . . . 0.0 113.48 -178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -74.32 161.24 79.03 Favored Pre-proline 0 CA--C 1.54 0.562 0 C-N-CA 123.879 0.871 . . . . 0.0 109.175 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.64 147.46 17.73 Favored 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.884 2.389 . . . . 0.0 110.847 169.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -70.28 1.69 4.6 Favored 'General case' 0 CA--C 1.54 0.583 0 O-C-N 121.381 -0.825 . . . . 0.0 112.064 174.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -127.0 10.87 7.02 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.704 2.002 . . . . 0.0 111.043 -174.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.6 m -61.09 148.88 38.94 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.804 0.842 . . . . 0.0 109.634 179.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -135.84 172.21 13.33 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 169.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -59.78 -38.03 80.71 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.46 0.304 . . . . 0.0 110.467 -176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.1 ttt -61.24 -40.24 93.28 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.83 -0.605 . . . . 0.0 112.068 -175.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 21.0 mmt -58.81 -55.64 32.5 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.757 0.789 . . . . 0.0 110.18 -179.782 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 38.5 mt -70.99 -29.37 65.31 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 118.68 -0.676 . . . . 0.0 110.328 -177.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.0 m -62.68 -45.63 91.91 Favored 'General case' 0 C--O 1.226 -0.138 0 CA-C-N 119.384 0.993 . . . . 0.0 109.115 175.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 49.4 tpp -60.05 -41.06 91.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 123.304 0.642 . . . . 0.0 110.385 176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.7 mt -68.91 -52.37 30.09 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.517 0.598 . . . . 0.0 112.273 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.9 m-85 -84.14 -26.63 28.72 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 -169.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.3 t30 -65.13 -11.66 42.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.344 1.429 . . . . 0.0 112.513 -178.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.91 -30.88 64.36 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.711 0.804 . . . . 0.0 111.445 170.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -86.18 134.97 37.58 Favored Pre-proline 0 CA--C 1.537 0.452 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.78 35.57 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 124.724 3.616 . . . . 0.0 113.543 -172.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.29 -7.72 0.78 Allowed Glycine 0 C--N 1.334 0.446 0 CA-C-O 118.084 -1.398 . . . . 0.0 113.701 179.232 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.62 150.57 12.11 Favored 'General case' 0 N--CA 1.45 -0.458 0 CA-C-N 119.613 1.706 . . . . 0.0 110.991 177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 39.1 mtmt -132.34 -50.83 0.94 Allowed 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 117.438 -1.268 . . . . 0.0 111.786 171.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -156.98 166.02 34.54 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 120.287 1.403 . . . . 0.0 112.448 -170.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 63.7 t -131.32 145.88 34.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 C-N-CA 126.69 1.996 . . . . 0.0 107.295 171.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -137.61 95.44 3.06 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -68.65 169.58 10.9 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 172.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.64 101.78 44.82 Favored Pre-proline 0 CA--C 1.537 0.467 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 169.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -72.96 24.67 0.3 Allowed 'Trans proline' 0 CA--C 1.545 1.039 0 C-N-CA 124.898 3.732 . . . . 0.0 115.26 -170.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.4 p30 -135.79 -8.79 2.12 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 127.614 2.366 . . . . 0.0 112.621 169.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 29.0 mtp180 -146.46 72.99 1.3 Allowed 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 105.129 -2.175 . . . . 0.0 105.129 171.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 18.6 m80 -57.95 -12.27 3.11 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.514 -0.741 . . . . 0.0 112.248 178.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -73.36 -6.39 45.88 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.265 1.026 . . . . 0.0 111.957 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -130.57 160.42 41.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 124.981 1.313 . . . . 0.0 109.418 173.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.85 177.69 8.4 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 123.558 0.743 . . . . 0.0 110.901 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -129.56 150.11 51.03 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 106.83 -1.545 . . . . 0.0 106.83 168.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 60.5 t -135.32 142.31 40.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 105.862 -1.903 . . . . 0.0 105.862 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -130.08 140.34 50.84 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 123.987 0.915 . . . . 0.0 109.333 -170.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.6 m-85 -133.24 166.44 22.47 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 127.129 2.172 . . . . 0.0 110.31 -169.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.9 m -71.21 -45.19 63.89 Favored 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 126.144 1.778 . . . . 0.0 110.953 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.28 145.7 35.86 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.602 0.715 . . . . 0.0 110.176 -169.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -60.47 -32.22 71.19 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.887 1.675 . . . . 0.0 111.333 -175.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -69.18 -36.15 77.02 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 121.735 -0.603 . . . . 0.0 110.384 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -81.42 -36.28 29.67 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.891 -175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.0 p -61.35 -42.29 98.46 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-N 119.169 0.895 . . . . 0.0 109.669 169.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.69 -48.08 78.45 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 122.937 0.495 . . . . 0.0 111.437 173.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.68 -43.51 97.64 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 118.199 0.454 . . . . 0.0 111.293 179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -65.21 -40.37 94.04 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 122.837 0.455 . . . . 0.0 111.477 178.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.4 tmtt? -57.52 -52.63 64.61 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 124.424 1.09 . . . . 0.0 108.835 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -59.3 -38.15 79.49 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.22 0.464 . . . . 0.0 110.738 -179.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.66 -37.54 67.9 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.013 0.925 . . . . 0.0 113.283 -176.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.1 mt -114.82 -2.62 12.91 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 114.005 1.113 . . . . 0.0 114.005 -169.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -56.58 129.24 40.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 120.361 1.437 . . . . 0.0 108.866 168.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.12 5.07 90.37 Favored Glycine 0 CA--C 1.534 1.258 0 C-N-CA 125.081 1.325 . . . . 0.0 113.649 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -72.02 121.7 19.61 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 119.4 1.6 . . . . 0.0 109.301 -175.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.11 108.28 1.5 Allowed 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 171.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 60.0 mt -70.96 -45.09 74.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 169.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.7 p -134.02 162.92 54.78 Favored Pre-proline 0 CA--C 1.534 0.34 0 N-CA-C 106.166 -1.791 . . . . 0.0 106.166 168.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -48.04 -20.86 2.36 Favored 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.491 3.461 . . . . 0.0 117.64 -169.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -120.8 10.84 11.02 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.974 1.31 . . . . 0.0 112.156 -174.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -132.36 73.05 1.51 Allowed 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.125 0.97 . . . . 0.0 109.106 -173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.04 106.16 1.87 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 169.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 38.5 ttm -48.11 122.6 5.34 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.927 1.691 . . . . 0.0 111.005 175.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.2 mtmt -101.24 143.82 30.84 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 105.803 -1.925 . . . . 0.0 105.803 168.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 17.7 mt -136.55 144.6 32.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 105.568 -2.012 . . . . 0.0 105.568 -176.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.46 153.7 39.89 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 125.323 1.449 . . . . 0.0 107.935 174.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -66.75 124.92 24.24 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 174.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -77.75 -169.71 1.6 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-O 121.564 0.697 . . . . 0.0 109.939 173.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -142.58 166.62 24.15 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 124.816 1.246 . . . . 0.0 108.528 -176.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt . . . . . 0 C--O 1.25 1.112 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 -179.821 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 119.508 -0.282 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -151.63 142.98 23.42 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 124.898 1.279 . . . . 0.0 108.397 177.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.0 p -76.1 158.71 31.49 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.931 0.893 . . . . 0.0 110.634 -176.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -141.97 129.7 21.62 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.276 -2.12 . . . . 0.0 105.276 169.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -150.63 168.86 10.19 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 125.484 1.514 . . . . 0.0 108.784 -169.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -50.66 160.86 1.53 Allowed 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 122.537 2.158 . . . . 0.0 111.728 154.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -48.37 141.34 19.23 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 123.574 2.849 . . . . 0.0 114.417 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -147.1 150.15 34.46 Favored 'General case' 0 C--O 1.231 0.081 0 C-N-CA 125.716 1.606 . . . . 0.0 107.663 177.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.84 7.2 3.3 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.864 1.266 . . . . 0.0 113.27 -176.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 13.9 mt -132.17 140.42 47.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 178.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 83.6 mt -124.44 144.61 49.98 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.661 1.584 . . . . 0.0 107.22 -176.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -112.24 137.1 50.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 169.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 8.5 mp -127.65 146.87 50.41 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -169.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 41.7 p -142.91 178.28 7.77 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.585 1.554 . . . . 0.0 109.802 -176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 58.0 t30 56.29 27.74 12.29 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.808 1.643 . . . . 0.0 113.026 -179.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -79.88 167.66 32.02 Favored Pre-proline 0 CA--C 1.543 0.702 0 C-N-CA 124.697 1.199 . . . . 0.0 109.261 -179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -49.15 159.7 1.0 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 123.368 2.712 . . . . 0.0 113.234 171.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -77.06 3.37 12.58 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.14 -0.975 . . . . 0.0 110.742 169.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -138.07 11.82 2.85 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.892 1.677 . . . . 0.0 112.213 -169.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -56.31 140.4 45.18 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.953 0.901 . . . . 0.0 108.872 177.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -137.18 166.51 23.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 170.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -50.61 -36.13 33.64 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.073 1.349 . . . . 0.0 112.461 -172.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 13.6 tmm? -60.4 -42.47 96.0 Favored 'General case' 0 C--O 1.228 -0.057 0 C-N-CA 123.731 0.812 . . . . 0.0 110.9 -177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 63.5 mtt -59.07 -56.83 17.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 121.747 0.784 . . . . 0.0 109.688 -175.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 34.5 mt -72.12 -31.56 66.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.561 -0.733 . . . . 0.0 110.102 -173.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.8 m -63.55 -49.12 74.68 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 119.019 0.827 . . . . 0.0 109.188 175.177 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.0 ttp -58.77 -35.33 72.61 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.901 0.88 . . . . 0.0 111.173 178.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.4 mt -76.67 -57.14 4.03 Favored 'General case' 0 C--N 1.339 0.143 0 CA-C-N 118.352 0.524 . . . . 0.0 111.455 179.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -79.05 -26.03 43.12 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 112.907 0.706 . . . . 0.0 112.907 -171.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 13.4 p-10 -66.79 -8.77 30.83 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 120.45 1.477 . . . . 0.0 113.213 -176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 40.9 mt-30 -61.24 -30.67 70.59 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.307 1.043 . . . . 0.0 110.984 171.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -82.65 136.91 44.72 Favored Pre-proline 0 C--O 1.236 0.377 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.99 30.81 0.36 Allowed 'Trans proline' 0 CA--C 1.547 1.142 0 C-N-CA 124.637 3.558 . . . . 0.0 113.559 -174.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.84 -6.69 1.08 Allowed Glycine 0 CA--C 1.523 0.533 0 CA-C-O 118.029 -1.428 . . . . 0.0 113.432 179.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -51.32 146.14 7.33 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.191 1.496 . . . . 0.0 110.398 174.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.4 ttpp -136.76 -45.76 0.59 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 117.57 -1.205 . . . . 0.0 112.314 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -159.88 164.19 33.75 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 120.376 1.444 . . . . 0.0 111.508 179.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 41.8 t -127.26 144.01 38.69 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 126.828 2.051 . . . . 0.0 106.723 169.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -136.3 88.37 2.38 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 179.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.57 171.48 4.07 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.512 1.125 . . . . 0.0 109.426 175.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 22.0 t -118.48 85.8 27.0 Favored Pre-proline 0 CA--C 1.532 0.272 0 N-CA-C 105.304 -2.11 . . . . 0.0 105.304 169.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -71.92 26.5 0.25 Allowed 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 125.174 3.916 . . . . 0.0 114.941 -173.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -133.71 2.61 3.46 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 127.679 2.392 . . . . 0.0 111.493 169.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.6 mmm-85 -132.02 -46.21 0.94 Allowed 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 124.342 1.057 . . . . 0.0 110.688 176.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 15.3 m170 61.18 -28.09 0.05 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 128.937 2.895 . . . . 0.0 115.462 -175.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.7 -8.98 59.57 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.854 1.262 . . . . 0.0 112.005 -174.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.09 156.68 42.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 125.43 1.492 . . . . 0.0 108.801 169.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.59 175.45 13.22 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 125.124 1.37 . . . . 0.0 109.984 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -129.93 152.94 48.85 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 124.161 0.984 . . . . 0.0 108.723 170.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 23.7 t -138.34 147.73 25.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -136.78 145.74 44.91 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 124.556 1.143 . . . . 0.0 109.332 -173.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -132.24 165.62 23.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 126.968 2.107 . . . . 0.0 110.372 -170.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.5 m -65.42 -46.4 80.11 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.755 1.622 . . . . 0.0 110.764 171.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -140.63 146.74 38.33 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 121.779 0.8 . . . . 0.0 110.755 -169.204 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -61.2 -33.17 73.04 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.794 1.638 . . . . 0.0 111.332 -176.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 10.7 mp -68.23 -35.92 78.7 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.16 0.584 . . . . 0.0 110.335 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -80.8 -38.8 27.82 Favored 'General case' 0 N--CA 1.456 -0.147 0 CA-C-O 118.39 -0.814 . . . . 0.0 110.624 -175.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.2 p -60.89 -41.15 95.46 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 119.357 0.98 . . . . 0.0 110.079 169.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -57.51 -49.82 75.08 Favored 'General case' 0 C--N 1.339 0.137 0 CA-C-N 118.525 0.602 . . . . 0.0 111.271 175.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.63 -42.43 96.88 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 122.103 -0.373 . . . . 0.0 111.348 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.26 96.1 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.848 0.459 . . . . 0.0 111.648 177.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.6 tttm -57.93 -52.74 64.25 Favored 'General case' 0 C--O 1.228 -0.078 0 C-N-CA 123.685 0.794 . . . . 0.0 109.031 174.019 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -62.25 -33.79 75.28 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.869 0.759 . . . . 0.0 110.99 -178.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.47 -37.98 71.3 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.982 0.913 . . . . 0.0 112.959 -179.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -113.66 -3.47 13.57 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 -169.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -57.17 128.52 37.39 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 120.116 1.325 . . . . 0.0 108.476 170.476 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.2 0.15 90.03 Favored Glycine 0 CA--C 1.533 1.183 0 C-N-CA 124.829 1.204 . . . . 0.0 113.766 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -67.95 121.8 16.84 Favored 'General case' 0 CA--C 1.527 0.086 0 CA-C-N 119.653 1.726 . . . . 0.0 109.412 -176.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.59 108.09 1.58 Allowed 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 173.249 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 80.2 mt -69.02 -44.23 81.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 105.101 -2.185 . . . . 0.0 105.101 169.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.403 ' HB ' ' HD2' ' A' ' 72' ' ' PRO . 9.8 p -134.57 162.18 59.24 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 168.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 71' ' ' THR . 9.2 Cg_endo -53.64 -15.53 6.64 Favored 'Trans proline' 0 CA--C 1.535 0.555 0 C-N-CA 123.522 2.815 . . . . 0.0 117.198 -169.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.7 p -121.99 12.63 10.46 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.696 1.198 . . . . 0.0 112.159 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -133.65 75.29 1.6 Allowed 'General case' 0 C--O 1.235 0.297 0 C-N-CA 124.294 1.038 . . . . 0.0 108.653 -176.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.31 108.53 2.78 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.112 -1.07 . . . . 0.0 108.112 169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.8 ttm -45.77 123.01 4.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.826 1.651 . . . . 0.0 110.4 174.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 61.0 tttt -107.82 139.1 42.92 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 173.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 22.1 mt -135.97 143.66 35.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.22 154.61 40.32 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 126.574 1.95 . . . . 0.0 107.466 -179.106 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -74.21 131.7 41.48 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 172.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.43 -176.63 5.79 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 169.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -130.6 126.45 36.71 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.212 1.005 . . . . 0.0 108.309 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 170.747 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -58.16 125.4 23.03 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.469 0.708 . . . . 0.0 109.884 177.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 3.6 p -72.54 161.39 30.86 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.857 1.263 . . . . 0.0 110.608 -175.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -128.46 159.76 34.41 Favored 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.545 1.138 . . . . 0.0 108.301 178.464 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 36.5 mm-40 -152.41 166.19 15.87 Favored Pre-proline 0 CA--C 1.538 0.496 0 C-N-CA 126.588 1.955 . . . . 0.0 108.176 -176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -50.7 158.83 2.61 Favored 'Trans proline' 0 CA--C 1.546 1.111 0 C-N-CA 122.697 2.265 . . . . 0.0 111.626 156.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 79.6 Cg_exo -49.95 144.02 22.59 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.202 2.601 . . . . 0.0 114.563 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 t30 -145.97 147.47 31.72 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.993 1.717 . . . . 0.0 107.512 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -74.07 13.97 0.48 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.964 1.306 . . . . 0.0 113.144 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 mt -138.36 140.44 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 91.1 mt -125.93 151.06 47.47 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 125.863 1.665 . . . . 0.0 107.786 -174.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -121.12 130.85 53.93 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.904 -1.887 . . . . 0.0 105.904 172.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.5 mp -125.63 153.6 43.53 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.243 1.017 . . . . 0.0 108.392 -170.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.421 HG22 HG22 ' A' ' 47' ' ' ILE . 0.8 OUTLIER -145.04 173.32 12.0 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.632 1.973 . . . . 0.0 110.038 -169.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.7 t30 51.59 32.76 9.52 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.281 1.832 . . . . 0.0 112.973 -176.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.3 mt -76.0 159.87 79.7 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 123.76 0.824 . . . . 0.0 109.241 177.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -51.88 150.47 17.74 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.986 2.458 . . . . 0.0 112.071 169.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -70.25 -2.5 13.51 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 121.577 -0.702 . . . . 0.0 111.883 170.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -119.22 9.13 11.63 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 126.658 1.983 . . . . 0.0 112.356 -176.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.9 m -64.36 142.71 58.32 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -135.97 164.25 28.41 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 106.414 -1.698 . . . . 0.0 106.414 169.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -58.39 -28.33 65.08 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.935 0.894 . . . . 0.0 111.661 -174.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.6 tmm? -54.45 -47.25 73.13 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.86 0.864 . . . . 0.0 110.807 176.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -61.06 -53.36 58.08 Favored 'General case' 0 N--CA 1.462 0.128 0 C-N-CA 123.462 0.705 . . . . 0.0 109.86 -175.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 51.0 mt -71.41 -32.6 68.59 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 118.757 -0.64 . . . . 0.0 110.432 -175.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.9 m -63.47 -46.63 85.3 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 119.166 0.894 . . . . 0.0 109.241 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 58.9 ttp -58.59 -40.98 84.75 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.556 0.742 . . . . 0.0 110.624 177.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.75 -54.13 11.23 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-N 118.366 0.53 . . . . 0.0 111.731 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -81.28 -26.49 35.69 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.76 -0.638 . . . . 0.0 112.657 -169.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -64.99 -11.8 42.92 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.419 1.463 . . . . 0.0 112.673 -179.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -57.48 -31.13 65.67 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.438 170.659 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.9 m-85 -84.27 137.44 39.67 Favored Pre-proline 0 CA--C 1.536 0.421 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 178.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -75.39 33.29 0.39 Allowed 'Trans proline' 0 CA--C 1.546 1.097 0 C-N-CA 124.628 3.552 . . . . 0.0 113.361 -174.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.38 -5.9 0.47 Allowed Glycine 0 C--N 1.335 0.507 0 CA-C-O 117.95 -1.472 . . . . 0.0 113.861 -178.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -56.58 151.18 14.11 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 119.796 1.798 . . . . 0.0 109.91 174.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.4 ttpp -136.6 -44.35 0.6 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.346 -1.311 . . . . 0.0 111.948 -178.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -163.31 172.84 14.08 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 120.477 1.489 . . . . 0.0 112.154 -177.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.1 t -131.28 154.32 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.513 0 C-N-CA 126.968 2.107 . . . . 0.0 107.442 169.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.99 100.54 4.19 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 169.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -70.52 172.64 8.15 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 109.03 -0.729 . . . . 0.0 109.03 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.8 t -119.57 84.42 30.02 Favored Pre-proline 0 C--N 1.326 -0.424 0 N-CA-C 104.031 -2.581 . . . . 0.0 104.031 169.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -73.79 28.84 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.939 0 C-N-CA 124.622 3.548 . . . . 0.0 114.163 -170.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -129.56 -3.46 4.8 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.92 2.488 . . . . 0.0 111.41 169.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.5 mtp180 -131.54 -38.96 1.15 Allowed 'General case' 0 C--N 1.346 0.449 0 CA-C-N 119.301 0.955 . . . . 0.0 112.186 172.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 60.2 -24.42 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 128.399 2.679 . . . . 0.0 115.642 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.71 -7.99 57.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 119.993 1.27 . . . . 0.0 112.638 -176.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.421 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -133.64 157.06 42.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 125.322 1.449 . . . . 0.0 108.963 172.012 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.12 177.92 10.77 Favored 'General case' 0 C--O 1.232 0.142 0 C-N-CA 124.856 1.263 . . . . 0.0 109.63 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 36.6 m-85 -128.43 152.64 47.98 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.629 1.171 . . . . 0.0 107.876 170.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 31.3 t -133.69 149.26 30.69 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 176.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -135.31 142.54 45.86 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 124.498 1.119 . . . . 0.0 108.581 -170.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -134.3 167.24 21.06 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 126.341 1.856 . . . . 0.0 110.774 -169.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.3 m -67.91 -46.64 70.98 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 126.082 1.753 . . . . 0.0 111.042 171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -142.77 149.73 39.08 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.837 0.827 . . . . 0.0 110.592 -169.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -64.81 -32.51 74.24 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 125.894 1.678 . . . . 0.0 111.279 -173.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.93 -37.49 75.93 Favored 'General case' 0 N--CA 1.458 -0.064 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 176.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -76.93 -38.26 53.74 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-O 118.384 -0.817 . . . . 0.0 110.659 -176.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 7.7 p -60.94 -42.49 98.31 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.268 0.94 . . . . 0.0 109.902 170.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -60.53 -45.08 95.17 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.99 0.814 . . . . 0.0 111.542 177.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.61 -43.62 97.25 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.87 -0.519 . . . . 0.0 111.312 178.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -40.08 95.17 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 122.808 0.443 . . . . 0.0 111.249 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -56.93 -52.76 63.92 Favored 'General case' 0 N--CA 1.456 -0.153 0 C-N-CA 124.207 1.003 . . . . 0.0 109.253 173.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 27.1 mm-40 -60.99 -36.1 78.59 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.108 0.867 . . . . 0.0 110.935 -179.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.77 -36.12 72.93 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.967 0.907 . . . . 0.0 112.932 -177.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.5 mt -115.84 -2.68 12.31 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -169.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mm-40 -54.92 123.38 13.3 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.646 1.112 . . . . 0.0 109.156 169.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.4 7.12 88.02 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.493 1.044 . . . . 0.0 113.648 179.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -75.76 124.89 28.03 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.324 1.562 . . . . 0.0 109.392 -176.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.49 109.44 1.96 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 173.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 99.0 mt -72.63 -44.7 60.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 169.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.5 p -132.72 162.17 58.98 Favored Pre-proline 0 C--O 1.235 0.31 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 168.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -47.6 -21.88 2.55 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 124.642 3.561 . . . . 0.0 117.574 -169.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.7 p -121.23 10.95 10.74 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.103 1.361 . . . . 0.0 112.138 -174.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -133.3 72.52 1.49 Allowed 'General case' 0 C--O 1.235 0.32 0 C-N-CA 124.129 0.972 . . . . 0.0 109.302 -173.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.2 108.45 3.16 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 11.4 ptp -59.07 146.63 37.78 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.477 0.58 . . . . 0.0 110.566 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -113.42 151.48 31.32 Favored 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 168.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 7.3 mt -135.89 147.95 28.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 -173.008 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.66 161.49 42.08 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 126.932 2.093 . . . . 0.0 106.249 175.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -73.32 143.43 46.95 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 169.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -83.06 169.87 15.45 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 106.964 -1.495 . . . . 0.0 106.964 168.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.2 mptt -129.62 53.64 1.89 Allowed 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -173.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt . . . . . 0 C--O 1.249 1.049 0 C-N-CA 126.154 1.782 . . . . 0.0 109.133 -174.194 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -60.1 143.96 50.87 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 169.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.3 p -145.24 147.78 32.78 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.912 0.885 . . . . 0.0 109.749 175.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -112.13 53.03 0.74 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.986 1.314 . . . . 0.0 107.645 -176.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -60.54 163.63 8.63 Favored Pre-proline 0 CA--C 1.542 0.639 0 C-N-CA 124.51 1.124 . . . . 0.0 110.637 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -48.86 153.55 3.69 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 121.96 1.773 . . . . 0.0 110.615 152.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -48.66 139.81 23.37 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.029 2.486 . . . . 0.0 114.101 -176.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -143.48 149.46 37.57 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.555 1.542 . . . . 0.0 107.828 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -71.46 4.36 3.08 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.813 1.245 . . . . 0.0 113.425 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 7.7 mt -131.57 141.68 45.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.326 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 85.1 mt -126.04 146.14 50.02 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.009 1.724 . . . . 0.0 107.235 -174.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -115.04 134.66 54.99 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 172.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 10.1 mp -126.74 147.6 49.96 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.368 1.067 . . . . 0.0 108.676 -169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.3 p -144.34 175.25 10.24 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 124.842 1.257 . . . . 0.0 110.506 -174.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.0 t30 55.55 30.49 15.35 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 126.194 1.798 . . . . 0.0 112.811 -177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 29.6 mt -79.52 163.03 61.08 Favored Pre-proline 0 CA--C 1.538 0.504 0 C-N-CA 124.557 1.143 . . . . 0.0 109.28 -179.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -49.11 147.82 10.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 123.225 2.617 . . . . 0.0 111.555 169.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -73.01 8.65 1.47 Allowed 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.161 -0.962 . . . . 0.0 112.175 169.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -132.25 10.13 4.47 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 127.598 2.359 . . . . 0.0 111.492 -176.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 3.9 m -61.31 146.4 48.15 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.298 -0.876 . . . . 0.0 109.192 -178.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -135.38 160.02 39.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -51.58 -38.3 53.83 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.783 1.233 . . . . 0.0 110.811 -179.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -64.37 -35.58 81.36 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.689 0.796 . . . . 0.0 112.343 -178.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 91.4 mmm -64.02 -53.69 45.95 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 121.502 0.668 . . . . 0.0 109.541 -178.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.0 mt -71.39 -32.23 68.2 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.669 -0.681 . . . . 0.0 109.883 -176.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m -63.14 -46.28 87.96 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-N 119.112 0.869 . . . . 0.0 109.34 175.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 64.6 ttp -57.77 -42.81 84.81 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.423 0.689 . . . . 0.0 110.512 176.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.7 -53.81 14.25 Favored 'General case' 0 C--N 1.34 0.175 0 CA-C-N 118.328 0.513 . . . . 0.0 111.641 -177.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -82.18 -26.64 33.22 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 -170.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -66.62 -9.93 40.65 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 120.513 1.506 . . . . 0.0 112.623 -179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -57.73 -31.15 66.16 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.527 -0.733 . . . . 0.0 111.186 169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -84.15 138.29 39.62 Favored Pre-proline 0 CA--C 1.538 0.488 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -75.85 28.84 0.38 Allowed 'Trans proline' 0 CA--C 1.546 1.104 0 C-N-CA 124.618 3.545 . . . . 0.0 114.196 -169.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -145.73 0.35 0.87 Allowed Glycine 0 CA--C 1.525 0.667 0 CA-C-O 118.498 -1.168 . . . . 0.0 113.883 -177.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -52.75 148.88 6.77 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-N 118.849 1.324 . . . . 0.0 110.383 172.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 15.1 ttpp -139.14 -41.83 0.47 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 117.747 -1.121 . . . . 0.0 112.618 -177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -161.45 167.25 25.94 Favored 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 120.364 1.438 . . . . 0.0 111.817 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.3 t -133.45 146.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.357 0 C-N-CA 127.164 2.186 . . . . 0.0 106.333 169.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -135.21 99.01 4.13 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 172.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -68.68 171.85 7.15 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 124.288 1.035 . . . . 0.0 108.959 172.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.4 t -122.61 84.99 48.7 Favored Pre-proline 0 N--CA 1.453 -0.315 0 N-CA-C 104.4 -2.444 . . . . 0.0 104.4 171.396 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -73.71 28.94 0.32 Allowed 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 124.487 3.458 . . . . 0.0 114.05 -171.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -126.93 -6.54 6.12 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 127.753 2.421 . . . . 0.0 111.337 169.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . 0.411 ' C ' ' H ' ' A' ' 46' ' ' ASP . 37.4 mtp180 -129.06 -39.47 1.56 Allowed 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.531 1.06 . . . . 0.0 111.957 169.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.9 m-70 60.9 -24.26 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 127.988 2.515 . . . . 0.0 114.807 -173.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 44' ' ' ARG . 7.0 t70 -70.13 -15.92 63.03 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 128.265 2.626 . . . . 0.0 112.301 -177.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.77 157.02 38.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 C-N-CA 125.104 1.362 . . . . 0.0 108.758 177.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.11 176.41 12.29 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.489 1.116 . . . . 0.0 109.863 -178.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.9 m-85 -129.27 150.92 50.44 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.494 1.118 . . . . 0.0 108.056 171.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 35.9 t -135.91 149.94 28.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 177.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -141.43 146.78 36.96 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.942 0.897 . . . . 0.0 109.543 -171.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -134.8 166.24 23.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 127.144 2.178 . . . . 0.0 109.542 -170.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 96.1 m -66.52 -47.67 72.19 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-O 118.58 -0.724 . . . . 0.0 110.858 171.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 46.3 p -127.99 156.99 41.83 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 122.61 1.195 . . . . 0.0 110.579 -176.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.66 -28.44 69.39 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 112.805 -1.998 . . . . 0.0 111.491 175.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.61 -42.8 64.1 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.175 0.59 . . . . 0.0 109.42 178.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -72.44 -41.83 65.7 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 118.677 -0.678 . . . . 0.0 109.956 -175.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.2 p -60.21 -43.19 96.16 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-N 118.933 0.788 . . . . 0.0 110.682 171.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -57.7 -48.88 78.33 Favored 'General case' 0 C--N 1.34 0.18 0 CA-C-N 118.64 0.654 . . . . 0.0 111.215 177.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.39 97.44 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.091 -0.381 . . . . 0.0 111.402 179.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.34 -39.23 93.47 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 122.629 0.372 . . . . 0.0 111.795 177.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.0 tttm -58.3 -52.92 63.56 Favored 'General case' 0 C--O 1.228 -0.074 0 C-N-CA 123.808 0.843 . . . . 0.0 109.061 173.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -61.52 -34.16 75.06 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.744 0.702 . . . . 0.0 110.825 -178.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.35 -38.92 74.91 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.959 0.903 . . . . 0.0 112.893 -179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 65.5 mt -114.55 -0.88 13.55 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -169.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -57.02 128.47 37.13 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 120.12 1.327 . . . . 0.0 108.927 170.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 80.75 5.85 89.75 Favored Glycine 0 CA--C 1.534 1.245 0 C-N-CA 125.01 1.291 . . . . 0.0 113.633 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -70.28 122.68 20.0 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 119.309 1.555 . . . . 0.0 109.33 -176.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.53 106.83 1.23 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 172.145 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 87.0 mt -69.92 -43.63 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 N-CA-C 104.975 -2.231 . . . . 0.0 104.975 169.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.5 p -133.92 161.55 63.04 Favored Pre-proline 0 CA--C 1.534 0.339 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_exo -47.48 -22.18 2.59 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.655 3.57 . . . . 0.0 117.722 -169.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.3 p -123.58 11.23 9.17 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.816 1.246 . . . . 0.0 112.075 -174.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.3 m-70 -129.9 75.74 1.67 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.381 1.073 . . . . 0.0 108.331 -176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 108.9 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 169.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 39.3 ttm -50.57 113.07 0.8 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.206 1.802 . . . . 0.0 111.815 174.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 40.2 mtmt -89.73 145.86 24.91 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 105.415 -2.068 . . . . 0.0 105.415 168.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 18.6 mt -136.37 143.46 35.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 N-CA-C 106.183 -1.784 . . . . 0.0 106.183 -178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -147.47 166.95 25.68 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 126.488 1.915 . . . . 0.0 107.693 175.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -80.82 129.38 34.49 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -79.97 -176.85 5.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 31.9 mtmm -128.95 169.19 14.96 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.991 0.917 . . . . 0.0 109.813 -170.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt . . . . . 0 C--O 1.25 1.115 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 -178.223 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.938 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -146.25 147.85 31.86 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 170.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 7.2 p -81.79 56.73 3.15 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 125.769 1.628 . . . . 0.0 110.594 -174.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -64.22 152.94 39.48 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.532 0.733 . . . . 0.0 110.17 179.722 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 19.3 mm-40 -147.92 171.72 6.01 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 126.048 1.739 . . . . 0.0 107.885 -174.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -50.4 156.68 3.83 Favored 'Trans proline' 0 CA--C 1.546 1.089 0 C-N-CA 122.174 1.916 . . . . 0.0 111.769 157.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -49.1 141.18 23.44 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 123.588 2.859 . . . . 0.0 113.851 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -148.55 148.24 29.96 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 125.189 1.395 . . . . 0.0 108.387 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -73.33 9.65 1.24 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.212 1.405 . . . . 0.0 114.033 -176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 20.4 mt -133.43 141.84 43.36 Favored 'Isoleucine or valine' 0 C--O 1.236 0.366 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 176.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 88.6 mt -124.34 144.47 49.99 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.405 1.482 . . . . 0.0 107.398 -176.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -111.39 137.83 48.67 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 170.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 9.0 mp -128.06 144.01 51.09 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 -169.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.0 p -143.13 178.75 7.49 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 124.935 1.294 . . . . 0.0 109.889 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.7 t30 55.43 27.26 9.87 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.712 1.605 . . . . 0.0 112.749 -177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 26.2 mt -78.5 168.99 22.85 Favored Pre-proline 0 CA--C 1.541 0.621 0 C-N-CA 124.532 1.133 . . . . 0.0 109.053 -178.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.77 158.79 1.82 Allowed 'Trans proline' 0 N--CA 1.457 -0.646 0 C-N-CA 122.871 2.381 . . . . 0.0 112.227 169.698 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -81.49 12.88 3.36 Favored 'General case' 0 CA--C 1.543 0.691 0 O-C-N 120.713 -1.242 . . . . 0.0 110.072 169.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -141.71 10.23 2.01 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.837 2.055 . . . . 0.0 111.573 -169.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -57.74 146.73 30.21 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 124.255 1.022 . . . . 0.0 109.012 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -133.76 155.12 50.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 179.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -49.53 -39.29 33.97 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.391 1.076 . . . . 0.0 111.273 179.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 97.3 mmm -66.48 -34.12 77.22 Favored 'General case' 0 CA--C 1.527 0.095 0 C-N-CA 123.715 0.806 . . . . 0.0 112.521 -178.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 93.2 mmm -61.19 -55.66 29.7 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.918 0.866 . . . . 0.0 109.071 -179.487 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 64.2 mt -70.48 -33.02 70.76 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.098 -176.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.1 m -62.34 -45.94 90.94 Favored 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 118.911 0.778 . . . . 0.0 109.561 176.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 16.2 tpt -59.29 -43.85 92.55 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.186 0.594 . . . . 0.0 110.307 176.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 86.7 mt -67.77 -51.5 48.33 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.421 0.555 . . . . 0.0 111.842 -177.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -83.24 -27.15 30.12 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -171.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.5 t30 -65.84 -10.84 41.64 Favored 'General case' 0 CA--C 1.539 0.553 0 CA-C-N 120.381 1.446 . . . . 0.0 112.557 -178.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 -56.18 -30.63 62.5 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.616 0.766 . . . . 0.0 111.541 170.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.19 137.37 31.12 Favored Pre-proline 0 CA--C 1.535 0.391 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.78 33.37 0.4 Allowed 'Trans proline' 0 CA--C 1.548 1.183 0 C-N-CA 124.718 3.612 . . . . 0.0 113.463 -172.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.41 -8.55 0.97 Allowed Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.017 -1.435 . . . . 0.0 113.378 -178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -54.61 146.89 15.48 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 119.533 1.667 . . . . 0.0 110.906 177.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -122.98 -57.47 1.7 Allowed 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.281 1.032 . . . . 0.0 108.669 173.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -163.96 176.12 9.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 119.035 0.834 . . . . 0.0 112.924 -171.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.0 t -130.45 151.1 35.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 C-N-CA 126.986 2.115 . . . . 0.0 107.085 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -133.78 94.31 3.26 Favored 'General case' 0 C--O 1.232 0.161 0 N-CA-C 105.966 -1.865 . . . . 0.0 105.966 170.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD13 ' H ' ' A' ' 41' ' ' VAL . 0.2 OUTLIER -66.4 169.75 6.99 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 172.223 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.412 ' C ' ' H ' ' A' ' 43' ' ' ASN . 25.7 t -118.61 84.54 24.69 Favored Pre-proline 0 N--CA 1.452 -0.334 0 N-CA-C 103.971 -2.603 . . . . 0.0 103.971 169.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -73.35 29.67 0.3 Allowed 'Trans proline' 0 CA--C 1.543 0.925 0 C-N-CA 124.458 3.439 . . . . 0.0 113.411 -174.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' H ' ' C ' ' A' ' 41' ' ' VAL . 59.5 m-80 -125.52 -7.95 6.88 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 128.11 2.564 . . . . 0.0 110.762 170.331 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -139.92 -36.69 0.49 Allowed 'General case' 0 C--N 1.348 0.535 0 CA-C-N 119.687 1.13 . . . . 0.0 111.841 177.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 57.7 m-70 63.45 -25.88 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.775 2.43 . . . . 0.0 115.802 176.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.82 -14.14 62.61 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 126.671 1.989 . . . . 0.0 111.74 -179.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.38 157.07 39.6 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 125.466 1.506 . . . . 0.0 109.286 177.182 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -160.33 174.61 13.91 Favored 'General case' 0 C--N 1.333 -0.128 0 C-N-CA 125.353 1.461 . . . . 0.0 109.628 -177.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -131.42 154.85 48.23 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.527 1.131 . . . . 0.0 108.338 171.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 38.3 t -139.58 141.01 35.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 N-CA-C 106.583 -1.636 . . . . 0.0 106.583 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -124.51 143.13 50.83 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 124.274 1.03 . . . . 0.0 109.119 -178.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -133.54 165.75 24.18 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 128.031 2.532 . . . . 0.0 110.289 -170.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 91.9 m -69.41 -46.51 66.68 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.71 1.604 . . . . 0.0 111.033 179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -142.69 149.05 38.32 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-O 121.737 0.779 . . . . 0.0 109.733 -169.155 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -62.82 -31.4 72.4 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.269 1.428 . . . . 0.0 111.074 -175.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.2 mp -68.2 -36.97 80.39 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.859 -0.525 . . . . 0.0 110.137 176.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -81.22 -36.05 30.5 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 118.314 -0.85 . . . . 0.0 111.001 -176.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 p -62.69 -41.08 98.92 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-N 119.44 1.018 . . . . 0.0 109.59 169.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 37.4 t30 -58.47 -46.59 86.29 Favored 'General case' 0 C--N 1.34 0.181 0 CA-C-N 118.603 0.638 . . . . 0.0 111.482 175.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.26 -44.63 96.93 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.853 -0.529 . . . . 0.0 111.451 177.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -39.62 94.35 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 122.887 0.475 . . . . 0.0 111.212 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -61.11 -50.52 72.9 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 124.3 1.04 . . . . 0.0 109.518 175.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -58.44 -38.32 77.24 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.418 0.554 . . . . 0.0 110.479 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.94 -37.5 69.99 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.869 0.867 . . . . 0.0 113.211 -177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 79.9 mt -114.25 -4.46 13.05 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -169.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -57.16 128.15 35.55 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 120.404 1.456 . . . . 0.0 108.627 169.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 82.43 1.03 90.39 Favored Glycine 0 CA--C 1.534 1.221 0 C-N-CA 124.62 1.105 . . . . 0.0 113.752 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -67.09 122.56 18.07 Favored 'General case' 0 C--O 1.232 0.139 0 CA-C-N 119.55 1.675 . . . . 0.0 109.305 -177.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.8 106.84 1.29 Allowed 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 171.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -71.42 -42.09 73.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 105.85 -1.907 . . . . 0.0 105.85 169.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 36.9 m -136.03 152.45 75.56 Favored Pre-proline 0 CA--C 1.539 0.519 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 170.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -46.11 -20.56 0.85 Allowed 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 124.813 3.675 . . . . 0.0 119.078 -169.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.0 p -121.01 15.5 11.6 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 120.022 1.283 . . . . 0.0 112.025 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 92.1 m-70 -133.66 72.91 1.49 Allowed 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.433 1.493 . . . . 0.0 108.147 -173.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.04 113.55 5.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 114.71 -1.132 . . . . 0.0 108.629 170.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 44.8 ttm -50.67 110.43 0.42 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 126.071 1.748 . . . . 0.0 111.968 176.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -89.19 143.99 26.44 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 168.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 14.7 mt -135.48 144.66 33.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 N-CA-C 106.73 -1.581 . . . . 0.0 106.73 -177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 11.9 m -139.06 147.6 42.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 128.189 2.595 . . . . 0.0 106.667 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 -70.26 122.58 19.79 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 169.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.73 178.44 4.8 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 172.024 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -122.86 172.9 8.12 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.868 1.267 . . . . 0.0 109.554 -178.776 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 C--O 1.249 1.072 0 N-CA-C 107.26 -1.385 . . . . 0.0 107.26 -177.09 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -58.23 127.37 31.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.427 0.691 . . . . 0.0 110.253 178.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -77.68 171.01 15.6 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.491 1.517 . . . . 0.0 110.712 -177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -129.57 167.33 18.08 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 125.292 1.437 . . . . 0.0 107.598 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -148.87 168.76 10.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 126.235 1.814 . . . . 0.0 108.195 -175.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -50.22 162.06 0.93 Allowed 'Trans proline' 0 CA--C 1.546 1.092 0 C-N-CA 122.303 2.002 . . . . 0.0 111.3 153.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_exo -47.94 143.26 13.82 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.178 2.586 . . . . 0.0 114.57 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -142.54 154.22 44.27 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.376 1.07 . . . . 0.0 108.892 175.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -62.63 -22.88 66.76 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 127.523 2.329 . . . . 0.0 113.754 -177.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.4 mt -125.79 145.72 32.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.073 -1.454 . . . . 0.0 107.073 -172.286 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.5 mt -124.29 147.33 48.21 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 126.706 2.002 . . . . 0.0 107.701 -175.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -111.26 137.89 48.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 169.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.6 mp -128.98 149.14 50.94 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 124.335 1.054 . . . . 0.0 108.922 -171.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.09 172.28 14.0 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 126.4 1.88 . . . . 0.0 110.719 -169.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.9 t30 58.14 16.36 3.83 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.952 2.101 . . . . 0.0 113.674 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.3 mt -67.8 159.9 76.42 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 124.451 1.1 . . . . 0.0 109.684 -175.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_exo -50.14 149.15 12.46 Favored 'Trans proline' 0 N--CA 1.457 -0.673 0 C-N-CA 122.846 2.364 . . . . 0.0 112.329 172.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -65.59 -7.53 15.41 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.592 -0.692 . . . . 0.0 112.399 169.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -118.51 10.25 12.56 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 126.774 2.03 . . . . 0.0 112.201 -174.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.6 m -59.68 145.52 44.58 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -136.76 156.26 48.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.49 -39.14 32.74 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.929 1.292 . . . . 0.0 111.721 179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 58.1 ttp -62.55 -35.48 79.6 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.791 0.836 . . . . 0.0 112.04 -179.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 59.9 mtt -64.05 -54.1 39.48 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.742 0.782 . . . . 0.0 109.437 -178.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 30.7 mt -71.02 -31.95 68.59 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 118.769 -0.634 . . . . 0.0 109.741 -176.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.5 m -60.36 -51.23 70.37 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 118.558 0.617 . . . . 0.0 109.772 174.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 22.5 ptp -65.4 -31.05 71.94 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.363 0.983 . . . . 0.0 111.61 -179.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 76.1 mt -70.88 -57.04 4.99 Favored 'General case' 0 C--N 1.342 0.274 0 CA-C-N 119.059 0.845 . . . . 0.0 111.265 177.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -78.02 -26.91 48.72 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.564 0.579 . . . . 0.0 112.564 -172.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -65.48 -11.09 40.04 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 120.323 1.42 . . . . 0.0 112.666 -178.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -56.59 -32.61 65.41 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.494 -0.754 . . . . 0.0 111.304 170.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -84.08 138.94 39.52 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 -179.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -76.2 36.63 0.5 Allowed 'Trans proline' 0 CA--C 1.545 1.055 0 C-N-CA 124.797 3.665 . . . . 0.0 113.214 -173.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -148.63 -4.25 0.3 Allowed Glycine 0 C--N 1.336 0.528 0 CA-C-O 117.925 -1.486 . . . . 0.0 113.867 -178.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -54.18 150.23 8.65 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.759 1.78 . . . . 0.0 110.541 175.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.1 ttpp -138.37 -45.13 0.5 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-O 117.401 -1.285 . . . . 0.0 112.711 178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -161.22 167.15 26.59 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 120.645 1.566 . . . . 0.0 112.26 -177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 70.1 t -134.7 152.67 33.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 C-N-CA 127.36 2.264 . . . . 0.0 108.29 172.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 20.4 tpt85 -143.12 108.28 4.98 Favored 'General case' 0 C--O 1.231 0.126 0 C-N-CA 125.004 1.322 . . . . 0.0 107.726 169.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -73.94 170.63 15.0 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 169.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 68.0 t -109.34 100.62 42.11 Favored Pre-proline 0 CA--C 1.538 0.5 0 N-CA-C 104.697 -2.334 . . . . 0.0 104.697 169.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -72.21 24.62 0.26 Allowed 'Trans proline' 0 CA--C 1.544 0.979 0 C-N-CA 124.909 3.74 . . . . 0.0 115.545 -170.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -135.31 -8.65 2.25 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 127.662 2.385 . . . . 0.0 112.554 169.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.7 mtp180 -147.13 73.08 1.29 Allowed 'General case' 0 N--CA 1.449 -0.525 0 C-N-CA 127.31 2.244 . . . . 0.0 105.274 172.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 19.1 m170 -57.31 -13.11 2.92 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 121.451 -0.781 . . . . 0.0 112.273 177.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -72.09 -5.94 38.94 Favored 'General case' 0 C--N 1.342 0.282 0 C-N-CA 124.61 1.164 . . . . 0.0 112.248 179.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -131.0 160.9 41.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 124.671 1.189 . . . . 0.0 109.878 172.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -163.13 177.65 8.92 Favored 'General case' 0 N--CA 1.462 0.168 0 C-N-CA 124.18 0.992 . . . . 0.0 110.307 -179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -131.28 149.71 52.45 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.415 1.486 . . . . 0.0 107.51 169.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 48.1 t -136.66 147.58 27.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.12 142.71 40.17 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 124.629 1.172 . . . . 0.0 108.966 -169.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -128.3 169.12 14.58 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.038 1.335 . . . . 0.0 110.781 -172.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 72.0 m -64.06 -47.16 81.24 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 125.374 1.469 . . . . 0.0 110.191 169.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.12 143.99 38.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 121.65 0.738 . . . . 0.0 109.708 -169.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.8 mp0 -59.05 -36.18 74.59 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 126.417 1.887 . . . . 0.0 111.095 -173.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.5 mt -72.82 -30.35 63.98 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.451 -178.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -79.8 -39.22 31.3 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-O 117.919 -1.038 . . . . 0.0 110.513 178.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.79 -40.44 92.63 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 119.997 1.271 . . . . 0.0 110.074 169.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -54.82 -55.3 31.68 Favored 'General case' 0 C--N 1.339 0.135 0 CA-C-N 118.716 0.689 . . . . 0.0 111.167 172.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -61.41 -41.1 96.62 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 118.261 0.482 . . . . 0.0 111.599 -176.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.31 -41.49 98.95 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.142 0.577 . . . . 0.0 111.618 176.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.5 tttm -59.32 -53.24 60.52 Favored 'General case' 0 N--CA 1.456 -0.163 0 C-N-CA 123.632 0.773 . . . . 0.0 109.334 175.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 44.1 mm-40 -62.74 -31.24 72.14 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 118.68 0.673 . . . . 0.0 110.91 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -71.12 -41.81 70.03 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.881 0.872 . . . . 0.0 112.706 177.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 59.8 mt -106.51 -3.62 20.66 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 -169.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -55.3 129.14 37.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.94 1.246 . . . . 0.0 108.46 167.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 81.46 0.94 89.84 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.899 1.238 . . . . 0.0 114.226 179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -69.0 123.32 20.71 Favored 'General case' 0 CA--C 1.529 0.15 0 CA-C-N 119.763 1.782 . . . . 0.0 109.318 -177.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.29 108.48 1.6 Allowed 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 172.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 69.8 mt -71.73 -44.72 68.46 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 105.3 -2.111 . . . . 0.0 105.3 169.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 54.5 p -132.71 161.66 62.11 Favored Pre-proline 0 C--O 1.235 0.331 0 N-CA-C 106.322 -1.733 . . . . 0.0 106.322 168.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -48.49 -20.7 2.72 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 124.573 3.515 . . . . 0.0 117.541 -169.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 17.5 p -123.34 10.89 9.29 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.08 1.352 . . . . 0.0 111.801 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 84.1 m-70 -131.53 77.84 1.79 Allowed 'General case' 0 C--O 1.234 0.273 0 C-N-CA 124.245 1.018 . . . . 0.0 109.17 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.82 114.18 6.19 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 106.995 -1.483 . . . . 0.0 106.995 169.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 47.5 ttm -49.41 126.94 14.22 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 125.818 1.647 . . . . 0.0 110.441 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -107.92 142.55 37.85 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 106.252 -1.758 . . . . 0.0 106.252 169.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 8.5 mt -140.38 143.21 29.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 -173.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -140.74 157.27 45.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.646 1.978 . . . . 0.0 106.882 169.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -66.35 142.57 57.58 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 120.772 -1.205 . . . . 0.0 108.695 170.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -80.12 162.48 24.74 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.68 -1.229 . . . . 0.0 107.68 169.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 5.3 mptt -123.65 27.68 7.25 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 123.471 0.709 . . . . 0.0 112.248 -174.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 38.0 mtmt . . . . . 0 C--O 1.25 1.094 0 C-N-CA 127.586 2.354 . . . . 0.0 110.488 177.133 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -139.19 57.46 1.66 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.519 0.676 . . . . 0.0 109.471 173.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.1 m -46.35 132.39 10.24 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.68 1.592 . . . . 0.0 110.03 178.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -87.7 155.98 19.67 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.577 0.751 . . . . 0.0 109.571 175.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -136.01 169.85 12.5 Favored Pre-proline 0 CA--C 1.54 0.561 0 C-N-CA 126.683 1.993 . . . . 0.0 107.753 -176.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -58.23 163.44 10.1 Favored 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 121.248 1.299 . . . . 0.0 110.026 155.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_exo -46.4 136.19 15.44 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 123.372 2.715 . . . . 0.0 113.884 -177.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 23.7 t30 -142.5 147.57 36.23 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 125.438 1.495 . . . . 0.0 107.745 178.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -72.68 8.12 1.61 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.314 1.446 . . . . 0.0 113.764 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 14.0 mt -132.9 141.46 44.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 178.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 90.7 mt -125.53 141.97 51.76 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.409 1.484 . . . . 0.0 107.298 -175.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -106.1 134.87 48.54 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 105.674 -1.973 . . . . 0.0 105.674 169.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.9 mp -124.27 143.24 50.66 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 -170.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -145.94 171.92 14.12 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.829 1.252 . . . . 0.0 110.244 -170.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 52.3 t30 54.27 29.39 10.64 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 125.774 1.629 . . . . 0.0 112.615 -176.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 21.5 mt -78.48 164.13 57.72 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.309 1.044 . . . . 0.0 109.15 -178.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -49.65 148.6 11.6 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.111 2.541 . . . . 0.0 111.417 169.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -71.67 5.94 2.2 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 121.352 -0.843 . . . . 0.0 112.375 170.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -131.89 12.05 4.76 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.943 2.097 . . . . 0.0 111.563 -176.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 4.1 m -59.47 144.72 46.3 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.443 -0.786 . . . . 0.0 108.93 179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -137.33 166.93 22.63 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 177.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -56.36 -39.8 73.49 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.099 0.96 . . . . 0.0 111.173 -174.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 16.3 tpt -69.85 -35.67 74.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 118.569 -0.729 . . . . 0.0 111.329 -174.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 22.6 mmt -57.01 -56.06 26.66 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.989 0.813 . . . . 0.0 109.641 178.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 60.8 mt -71.13 -32.43 68.97 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.374 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.8 m -63.4 -45.26 91.87 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 119.097 0.862 . . . . 0.0 109.222 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 52.8 ttm -59.7 -41.76 91.49 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.566 0.747 . . . . 0.0 110.292 177.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 85.1 mt -68.96 -53.22 21.98 Favored 'General case' 0 C--N 1.34 0.16 0 CA-C-N 118.451 0.569 . . . . 0.0 111.752 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -82.83 -26.77 31.37 Favored 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.097 0.776 . . . . 0.0 113.097 -170.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -65.73 -10.87 40.69 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 120.325 1.42 . . . . 0.0 112.597 -178.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -56.35 -30.48 62.71 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.555 0.742 . . . . 0.0 111.488 170.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -87.94 136.03 32.87 Favored Pre-proline 0 CA--C 1.535 0.396 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 179.114 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.56 33.06 0.39 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 124.678 3.585 . . . . 0.0 113.548 -172.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.23 -8.34 1.01 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-O 118.036 -1.424 . . . . 0.0 113.474 -179.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -55.37 149.84 12.47 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 119.465 1.632 . . . . 0.0 110.718 175.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mtpt -131.91 -51.46 0.97 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 117.568 -1.206 . . . . 0.0 111.543 173.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.1 tt0 -157.07 164.44 37.91 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.16 1.346 . . . . 0.0 112.112 -170.171 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.5 t -127.51 145.43 34.93 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 C-N-CA 126.662 1.985 . . . . 0.0 106.97 170.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 58.4 mtt180 -135.08 91.02 2.7 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 105.778 -1.934 . . . . 0.0 105.778 178.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.26 172.42 3.93 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.807 1.243 . . . . 0.0 109.465 176.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 39.1 t -120.99 84.12 38.7 Favored Pre-proline 0 N--CA 1.452 -0.341 0 N-CA-C 104.332 -2.47 . . . . 0.0 104.332 169.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -73.81 28.83 0.32 Allowed 'Trans proline' 0 CA--C 1.543 0.97 0 C-N-CA 124.642 3.562 . . . . 0.0 114.032 -171.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -130.5 -2.65 4.32 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 127.916 2.486 . . . . 0.0 111.464 169.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -132.22 -40.31 1.02 Allowed 'General case' 0 C--N 1.347 0.486 0 CA-C-N 119.375 0.989 . . . . 0.0 112.006 171.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 64.7 m-70 61.84 -26.48 0.05 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.416 2.686 . . . . 0.0 115.3 -179.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -77.0 -6.6 53.27 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.927 1.291 . . . . 0.0 112.192 -176.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.2 157.55 41.72 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 C-N-CA 125.347 1.459 . . . . 0.0 108.65 169.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -159.24 176.84 11.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 125.352 1.461 . . . . 0.0 109.524 -179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -129.64 153.55 47.99 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.362 1.065 . . . . 0.0 108.232 170.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 37.7 t -137.99 145.97 27.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 106.466 -1.679 . . . . 0.0 106.466 178.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -133.13 143.37 49.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 124.712 1.205 . . . . 0.0 109.45 -174.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -134.68 164.38 27.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.514 2.326 . . . . 0.0 110.338 -170.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 98.9 m -64.59 -47.88 77.03 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 126.738 2.015 . . . . 0.0 111.385 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -141.67 147.71 37.94 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-O 121.773 0.797 . . . . 0.0 110.216 -169.169 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.21 -32.64 72.41 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 125.952 1.701 . . . . 0.0 111.139 -177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.0 mp -67.58 -36.33 80.7 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 123.138 0.575 . . . . 0.0 110.296 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -81.91 -38.22 25.64 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-O 118.291 -0.862 . . . . 0.0 110.522 -175.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 p -61.24 -40.05 92.58 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 119.583 1.083 . . . . 0.0 109.881 169.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -59.29 -46.03 89.67 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 118.785 0.72 . . . . 0.0 111.593 175.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -60.53 -43.75 96.81 Favored 'General case' 0 CA--C 1.53 0.208 0 O-C-N 121.95 -0.468 . . . . 0.0 111.074 177.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.36 -38.93 92.77 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 122.892 0.477 . . . . 0.0 111.321 178.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -60.02 -51.68 68.59 Favored 'General case' 0 N--CA 1.457 -0.076 0 C-N-CA 124.141 0.976 . . . . 0.0 109.316 175.343 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 16.7 mm-40 -58.44 -37.78 76.12 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.063 0.392 . . . . 0.0 110.694 179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -74.15 -35.83 64.08 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.661 0.986 . . . . 0.0 113.661 -176.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 83.2 mt -117.25 -2.57 11.59 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -169.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -58.0 131.08 49.37 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 120.122 1.328 . . . . 0.0 108.977 167.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 79.32 4.9 89.23 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 124.908 1.242 . . . . 0.0 113.441 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 74.1 t80 -72.08 121.79 19.83 Favored 'General case' 0 C--N 1.339 0.112 0 CA-C-N 119.243 1.522 . . . . 0.0 109.101 -175.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -64.38 106.65 1.16 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 171.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 82.1 mt -69.84 -43.48 79.68 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 169.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.2 p -134.04 161.4 63.95 Favored Pre-proline 0 CA--C 1.533 0.318 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 168.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -47.55 -22.18 2.68 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 124.669 3.579 . . . . 0.0 117.753 -169.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 14.6 p -123.85 11.45 9.02 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.821 1.248 . . . . 0.0 112.073 -174.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -130.26 76.15 1.7 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.403 1.081 . . . . 0.0 108.329 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.11 110.09 3.81 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.617 -1.174 . . . . 0.0 108.176 169.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 40.2 ttm -50.97 117.93 2.85 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 125.798 1.639 . . . . 0.0 111.462 175.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 31.1 mtmt -94.71 148.91 21.79 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 105.4 -2.074 . . . . 0.0 105.4 168.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 44.6 mt -136.47 140.14 43.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 105.867 -1.901 . . . . 0.0 105.867 -179.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -138.93 149.88 45.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.499 1.92 . . . . 0.0 106.631 174.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 45.0 m-85 -69.46 122.84 19.79 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -73.61 -174.97 1.87 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 169.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mtpt -123.37 176.06 6.36 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 124.05 0.94 . . . . 0.0 110.331 -176.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt . . . . . 0 C--O 1.25 1.123 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 173.834 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -67.12 171.48 5.59 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.067 0.46 . . . . 0.0 111.032 176.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.7 p -132.98 67.58 1.53 Allowed 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.935 1.294 . . . . 0.0 108.358 -172.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.32 153.49 26.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 173.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -147.88 171.98 5.71 Favored Pre-proline 0 CA--C 1.538 0.492 0 C-N-CA 125.877 1.671 . . . . 0.0 108.426 -170.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -48.22 151.0 4.68 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 C-N-CA 122.166 1.911 . . . . 0.0 111.656 157.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -49.66 146.0 16.24 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 123.83 3.02 . . . . 0.0 115.51 -175.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.4 t30 -145.47 150.1 35.87 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.789 1.635 . . . . 0.0 108.079 170.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.38 7.01 3.87 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.761 1.224 . . . . 0.0 113.847 -176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 42.9 mt -131.81 141.2 46.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 105.387 -2.079 . . . . 0.0 105.387 177.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 84.7 mt -124.72 148.6 47.96 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 125.77 1.628 . . . . 0.0 107.505 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -116.23 136.0 53.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 105.843 -1.91 . . . . 0.0 105.843 169.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.407 ' HB3' HD21 ' A' ' 16' ' ' LEU . 9.2 mp -127.71 146.05 50.7 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 -169.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 19.5 p -143.78 174.42 10.83 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.502 1.521 . . . . 0.0 109.751 -172.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.3 t30 55.55 25.91 8.48 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.606 1.563 . . . . 0.0 113.098 -177.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.407 HD21 ' HB3' ' A' ' 13' ' ' LEU . 19.2 mt -76.41 164.46 59.66 Favored Pre-proline 0 CA--C 1.538 0.515 0 C-N-CA 124.524 1.13 . . . . 0.0 108.976 179.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -48.95 148.18 9.51 Favored 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 123.024 2.482 . . . . 0.0 111.429 169.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -72.25 8.53 1.29 Allowed 'General case' 0 CA--C 1.543 0.684 0 O-C-N 121.425 -0.797 . . . . 0.0 111.409 170.3 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -136.89 12.23 3.12 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 127.057 2.143 . . . . 0.0 111.139 -175.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 5.6 m -56.97 144.53 33.56 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.942 0.897 . . . . 0.0 108.861 176.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -135.38 155.9 49.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.48 -36.97 67.19 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.798 1.239 . . . . 0.0 110.845 -176.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.25 -41.43 96.89 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.992 0.917 . . . . 0.0 111.422 178.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 64.5 mtt -59.24 -55.77 30.62 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.626 0.727 . . . . 0.0 109.141 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.1 mt -69.57 -30.8 68.66 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.457 -174.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 52.0 m -58.07 -51.49 69.49 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 118.617 0.644 . . . . 0.0 109.327 172.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 26.0 mmt -62.39 -34.85 77.52 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 118.883 0.765 . . . . 0.0 111.286 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 73.0 mt -68.8 -52.83 26.0 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 119.452 -0.309 . . . . 0.0 111.486 179.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -88.1 -23.69 23.62 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 113.354 0.872 . . . . 0.0 113.354 -172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -64.64 -10.31 25.8 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 120.406 1.457 . . . . 0.0 112.956 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -59.6 -33.49 71.54 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.657 1.183 . . . . 0.0 111.147 171.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -80.82 136.81 50.82 Favored Pre-proline 0 CA--C 1.535 0.383 0 N-CA-C 108.658 -0.867 . . . . 0.0 108.658 -178.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -73.58 24.7 0.32 Allowed 'Trans proline' 0 CA--C 1.546 1.08 0 C-N-CA 124.421 3.414 . . . . 0.0 113.672 -175.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -139.71 -6.58 1.11 Allowed Glycine 0 C--N 1.337 0.593 0 CA-C-O 117.751 -1.583 . . . . 0.0 113.534 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -58.33 147.88 29.5 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 119.759 1.78 . . . . 0.0 108.596 172.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.0 mtpt -129.37 -50.31 1.18 Allowed 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.387 177.319 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -161.38 174.51 13.39 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 119.304 0.957 . . . . 0.0 110.661 -174.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.2 p -152.04 154.69 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 125.987 1.715 . . . . 0.0 107.037 174.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -136.85 143.81 43.27 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 125.828 1.651 . . . . 0.0 106.661 177.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -111.33 169.97 8.44 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.418 1.087 . . . . 0.0 108.504 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 45.8 t -108.3 91.15 7.79 Favored Pre-proline 0 C--N 1.331 -0.226 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 169.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -73.39 26.2 0.31 Allowed 'Trans proline' 0 CA--C 1.542 0.883 0 C-N-CA 124.798 3.665 . . . . 0.0 114.78 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 11.9 p30 -131.29 -1.43 3.99 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.398 2.279 . . . . 0.0 111.992 169.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -133.84 -41.97 0.83 Allowed 'General case' 0 C--N 1.345 0.412 0 CA-C-N 119.297 0.953 . . . . 0.0 112.086 173.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 16.5 m80 58.83 -23.9 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 128.886 2.874 . . . . 0.0 115.754 -173.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -75.13 -4.29 37.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.79 1.177 . . . . 0.0 112.242 -173.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.57 154.96 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 C-N-CA 125.748 1.619 . . . . 0.0 109.13 170.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.46 172.8 17.9 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.411 1.484 . . . . 0.0 110.223 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -131.67 139.79 49.16 Favored 'General case' 0 N--CA 1.461 0.091 0 C-N-CA 123.943 0.897 . . . . 0.0 108.975 173.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 53.5 t -129.26 147.94 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -175.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -138.53 140.81 39.25 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 124.525 1.13 . . . . 0.0 109.926 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -133.8 164.34 27.45 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 127.004 2.122 . . . . 0.0 111.052 -169.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 97.4 m -62.36 -48.56 79.24 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 126.882 2.073 . . . . 0.0 111.585 172.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -143.07 149.18 37.83 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.697 0.761 . . . . 0.0 110.12 -169.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -61.58 -34.25 75.29 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.547 1.539 . . . . 0.0 110.852 -176.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 11.1 mp -66.59 -37.66 85.39 Favored 'General case' 0 C--O 1.231 0.128 0 O-C-N 121.833 -0.542 . . . . 0.0 110.149 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -79.07 -40.31 31.56 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.814 -176.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 12.3 p -60.3 -41.18 92.86 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.395 0.998 . . . . 0.0 110.196 170.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 16.7 t30 -58.15 -50.43 73.54 Favored 'General case' 0 C--O 1.226 -0.15 0 CA-C-N 118.681 0.673 . . . . 0.0 111.451 176.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.31 -41.23 98.36 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.036 0.38 . . . . 0.0 111.407 -179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -64.22 -41.6 96.95 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.013 0.525 . . . . 0.0 111.329 176.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.5 tmtt? -60.17 -50.34 74.06 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 124.191 0.996 . . . . 0.0 108.981 175.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -62.06 -34.61 76.59 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 119.016 0.825 . . . . 0.0 110.967 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -70.82 -40.42 72.46 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.944 0.898 . . . . 0.0 112.643 -179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 62.2 mt -110.38 -6.05 15.06 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -169.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -62.53 124.59 21.37 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 120.714 1.597 . . . . 0.0 107.904 175.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 90.91 -2.36 79.54 Favored Glycine 0 CA--C 1.536 1.375 0 C-N-CA 125.082 1.325 . . . . 0.0 114.054 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -67.38 123.0 19.16 Favored 'General case' 0 C--N 1.339 0.152 0 CA-C-N 119.72 1.76 . . . . 0.0 109.607 -177.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.46 108.01 1.53 Allowed 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 172.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 79.6 mt -69.89 -43.92 79.18 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 169.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 40.3 p -133.94 161.47 63.52 Favored Pre-proline 0 CA--C 1.534 0.341 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 168.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -47.67 -22.03 2.75 Favored 'Trans proline' 0 C--N 1.35 0.641 0 C-N-CA 124.607 3.538 . . . . 0.0 117.698 -169.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.2 p -123.86 10.99 8.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.875 1.27 . . . . 0.0 112.029 -174.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 80.7 m-70 -130.78 76.8 1.75 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 124.386 1.074 . . . . 0.0 108.384 -176.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 114.15 5.68 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 114.481 -1.236 . . . . 0.0 108.326 169.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.7 ttm -51.34 106.6 0.14 Allowed 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.461 1.904 . . . . 0.0 111.442 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -87.44 142.79 27.6 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 169.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 21.8 mt -135.97 140.8 43.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 105.816 -1.92 . . . . 0.0 105.816 -174.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 4.3 m -139.28 153.5 47.79 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 126.935 2.094 . . . . 0.0 106.068 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -71.66 134.22 46.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 169.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -71.09 153.23 42.73 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 169.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.8 mppt? -118.06 106.12 12.56 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 36.6 mtmt . . . . . 0 C--O 1.249 1.043 0 C-N-CA 124.107 0.963 . . . . 0.0 108.907 -179.043 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.075 0 CA-C-O 119.526 -0.274 . . . . 0.0 110.41 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -151.51 160.62 43.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 125.204 1.401 . . . . 0.0 108.587 177.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.9 m -145.46 143.13 29.85 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -74.53 140.78 44.72 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 169.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 27.9 mm-40 -148.07 164.65 21.19 Favored Pre-proline 0 CA--C 1.538 0.514 0 C-N-CA 125.198 1.399 . . . . 0.0 108.379 -174.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -52.09 158.45 5.03 Favored 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 122.666 2.244 . . . . 0.0 111.867 161.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.29 140.08 20.87 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 123.556 2.837 . . . . 0.0 113.576 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 22.1 t30 -147.78 149.72 32.88 Favored 'General case' 0 CA--C 1.527 0.068 0 C-N-CA 125.563 1.545 . . . . 0.0 107.76 176.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -74.22 7.3 2.86 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.869 1.268 . . . . 0.0 113.46 -176.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.4 mt -132.1 141.1 46.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 105.579 -2.008 . . . . 0.0 105.579 176.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 82.7 mt -123.13 147.69 46.52 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.91 1.684 . . . . 0.0 107.32 -177.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -112.28 133.84 54.16 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.452 -2.055 . . . . 0.0 105.452 169.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 5.2 mp -123.27 144.61 49.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.003 1.321 . . . . 0.0 108.107 -169.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.427 HG22 HG22 ' A' ' 47' ' ' ILE . 0.7 OUTLIER -145.61 172.03 13.85 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 125.541 1.537 . . . . 0.0 110.142 -169.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 50.6 t30 55.24 28.68 11.55 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.94 1.696 . . . . 0.0 112.592 -177.168 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 25.3 mt -78.22 161.18 71.4 Favored Pre-proline 0 CA--C 1.54 0.565 0 C-N-CA 124.058 0.943 . . . . 0.0 109.481 -177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -51.63 150.91 15.53 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 123.139 2.559 . . . . 0.0 112.646 171.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.6 -2.73 9.64 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.69 0.796 . . . . 0.0 112.392 169.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -124.83 12.74 8.5 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 126.936 2.095 . . . . 0.0 112.043 -174.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 10.6 m -61.13 146.91 45.81 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 123.676 0.79 . . . . 0.0 109.355 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -140.88 157.2 45.72 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 -178.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -46.61 -43.81 17.68 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.553 1.541 . . . . 0.0 111.543 177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.51 -35.28 80.39 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.236 0.614 . . . . 0.0 111.618 -176.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 25.8 mmt -63.97 -55.15 24.6 Favored 'General case' 0 CA--C 1.52 -0.208 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 -177.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 31.5 mt -69.62 -34.58 74.26 Favored 'General case' 0 N--CA 1.456 -0.166 0 CA-C-O 118.79 -0.624 . . . . 0.0 110.438 -176.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.9 m -61.41 -47.09 87.38 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.449 0.568 . . . . 0.0 109.502 177.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 50.4 tpp -59.34 -42.8 92.35 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 123.139 0.576 . . . . 0.0 110.629 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.51 -51.21 53.69 Favored 'General case' 0 C--N 1.341 0.219 0 CA-C-O 119.075 -0.488 . . . . 0.0 111.454 -177.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -82.38 -25.21 33.99 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.183 0.809 . . . . 0.0 113.183 -173.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 45.9 t30 -64.89 -14.02 58.42 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 120.226 1.375 . . . . 0.0 113.392 -175.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -57.49 -29.1 64.0 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.506 -0.746 . . . . 0.0 111.732 172.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 34.0 m-85 -85.71 134.59 39.39 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -75.38 36.17 0.45 Allowed 'Trans proline' 0 CA--C 1.547 1.17 0 C-N-CA 124.661 3.574 . . . . 0.0 113.453 -172.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -143.19 -7.46 0.58 Allowed Glycine 0 CA--C 1.522 0.491 0 CA-C-O 117.691 -1.616 . . . . 0.0 113.555 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -56.2 150.72 13.75 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 119.978 1.889 . . . . 0.0 110.489 175.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 38.5 mtmt -132.23 -50.66 0.94 Allowed 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 117.845 -1.074 . . . . 0.0 111.697 170.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -160.47 167.83 26.4 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 119.79 1.177 . . . . 0.0 111.863 -169.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 m -133.01 163.29 38.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 124.685 1.194 . . . . 0.0 109.546 169.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 -136.7 99.42 4.05 Favored 'General case' 0 CA--C 1.521 -0.167 0 N-CA-C 106.119 -1.808 . . . . 0.0 106.119 174.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -68.58 168.44 12.98 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 169.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 41.2 t -118.08 85.98 25.14 Favored Pre-proline 0 C--N 1.329 -0.293 0 N-CA-C 104.844 -2.28 . . . . 0.0 104.844 169.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.02 28.44 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.931 0 C-N-CA 124.569 3.513 . . . . 0.0 114.333 -170.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 12.4 p30 -130.27 -2.52 4.45 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 127.817 2.447 . . . . 0.0 111.486 169.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 17.3 mtp180 -132.65 -40.36 0.97 Allowed 'General case' 0 C--N 1.346 0.422 0 CA-C-N 119.239 0.927 . . . . 0.0 111.93 172.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 60.72 -24.47 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 128.659 2.784 . . . . 0.0 115.273 -177.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -76.87 -7.0 54.7 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 124.741 1.217 . . . . 0.0 112.598 -176.682 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.427 HG22 HG22 ' A' ' 14' ' ' THR . 0.2 OUTLIER -134.16 157.84 41.88 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 C-N-CA 125.142 1.377 . . . . 0.0 109.441 171.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -158.71 177.56 11.06 Favored 'General case' 0 CA--C 1.528 0.135 0 C-N-CA 125.778 1.631 . . . . 0.0 108.94 -179.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 27.5 m-85 -130.68 155.4 46.67 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 169.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 96.4 t -136.73 143.99 33.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 69.8 tt0 -132.71 139.98 47.89 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 125.015 1.326 . . . . 0.0 109.056 -175.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -132.19 166.91 20.76 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 127.783 2.433 . . . . 0.0 110.601 -169.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 87.7 m -69.32 -46.24 67.57 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 125.915 1.686 . . . . 0.0 110.745 176.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -140.88 146.61 37.71 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 121.749 0.785 . . . . 0.0 110.498 -169.077 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -62.04 -32.83 73.37 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 125.503 1.521 . . . . 0.0 111.344 -175.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -69.94 -34.23 73.16 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.944 -0.472 . . . . 0.0 110.526 177.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -80.81 -37.69 29.71 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 118.57 -0.729 . . . . 0.0 110.765 -176.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.6 p -62.52 -39.76 94.6 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.285 0.948 . . . . 0.0 109.836 169.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.6 t30 -58.35 -48.52 80.31 Favored 'General case' 0 C--N 1.339 0.136 0 CA-C-N 118.474 0.579 . . . . 0.0 111.312 174.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.03 91.6 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.33 0.514 . . . . 0.0 111.195 177.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.46 91.24 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.887 0.475 . . . . 0.0 111.733 177.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 43.6 tttm -58.54 -54.47 46.67 Favored 'General case' 0 CA--C 1.522 -0.125 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 173.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -60.64 -33.92 73.51 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.37 0.532 . . . . 0.0 110.589 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -72.65 -37.92 67.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.063 0.945 . . . . 0.0 113.393 -179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.1 mt -115.41 -4.55 12.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -169.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -56.87 127.57 32.42 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 120.363 1.438 . . . . 0.0 108.527 167.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.24 -0.81 88.78 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 124.703 1.144 . . . . 0.0 113.838 -179.674 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -69.46 122.54 19.18 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 119.644 1.722 . . . . 0.0 109.399 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -64.37 108.13 1.53 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 171.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 81.4 mt -69.86 -44.32 78.95 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 N-CA-C 105.186 -2.153 . . . . 0.0 105.186 169.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 47.1 p -134.32 162.03 60.15 Favored Pre-proline 0 CA--C 1.534 0.333 0 N-CA-C 106.13 -1.804 . . . . 0.0 106.13 168.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -47.81 -20.92 2.16 Favored 'Trans proline' 0 C--N 1.35 0.647 0 C-N-CA 124.558 3.505 . . . . 0.0 117.75 -169.5 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 13.8 p -122.83 11.38 9.68 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.989 1.316 . . . . 0.0 112.08 -173.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 69.5 m80 -133.4 75.46 1.61 Allowed 'General case' 0 C--O 1.235 0.323 0 C-N-CA 124.087 0.955 . . . . 0.0 108.784 -174.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.77 112.05 4.03 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 169.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 49.1 ttm -48.65 125.72 10.5 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.866 1.666 . . . . 0.0 110.682 175.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -107.14 144.61 33.61 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 33.5 mt -136.05 143.33 36.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 N-CA-C 106.254 -1.758 . . . . 0.0 106.254 -173.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -139.72 153.77 47.29 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 127.022 2.129 . . . . 0.0 106.41 169.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 -70.56 131.28 43.74 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -75.97 178.17 6.47 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 169.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt -128.68 116.64 19.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 -177.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt . . . . . 0 C--O 1.25 1.109 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 172.536 . . . . . . . . 0 0 . 1 stop_ save_